diff --git "a/src/data/isomer_design_dataset.csv" "b/src/data/isomer_design_dataset.csv"
new file mode 100644--- /dev/null
+++ "b/src/data/isomer_design_dataset.csv"
@@ -0,0 +1,15367 @@
+smiles	name	properties
+O=C1CCCCC1(c1ccccc1Cl)N1CCCCC1	2-Cl-2'-Oxo-PCP	arylcycloalkylamine
+CCCCNC1(c2ccccc2)CCCCC1	PCB	arylcycloalkylamine
+COc1ccccc1C1(N2CCCCC2)CCCCC1	2-MeO-PCP	arylcycloalkylamine
+c1ccc(C2(n3cccc3)CCCCC2)cc1	PCPyrrole	arylcycloalkylamine
+Fc1cccc(C2(N3CCCC3)CC3CCC2C3)c1	3F-PBCHPy	arylcycloalkylamine
+COc1ccc(C2(NCC3CCCO3)CCCCC2)cc1	1-(4-Methoxyphenyl)-N-[(oxolan-2-yl)methyl]cyclohexan-1-amine	arylcycloalkylamine
+COc1ccc(C2(N3CCCC3)CC3CCC2C3)cc1	4-MeO-PBCHPy	arylcycloalkylamine
+C=CCN(CC)C1(c2ccccc2)CCCCC1	N-Allyl-PCE	arylcycloalkylamine
+CCCCCNC1(c2ccccc2)CCCCC1	PCPe	arylcycloalkylamine
+OC1CCCCC1(c1ccccc1)N1CCCCC1	2'-HO-PCP	arylcycloalkylamine
+Cc1ccccc1C1(N2CCCC(O)C2)CCCCC1	3″-HO-2-Me-PCP	arylcycloalkylamine
+c1ccc(C2(N3CCCCC3)CCCC2)cc1	PCPEP	arylcycloalkylamine
+CCN(C)C1(c2ccccc2C)CCCCC1	2-Me-PCEM	arylcycloalkylamine
+Fc1ccccc1C1(N2CCCC2)CC2CCC1C2	2F-PBCHPy	arylcycloalkylamine
+CC(C)OCCCNC1(c2ccccc2)CCCCC1	1-Phenyl-N-{3-[(propan-2-yl)oxy]propyl}cyclohexan-1-amine	arylcycloalkylamine
+CCNC1(c2ccc(C)cc2)CCCCC1	4-Me-PCE	arylcycloalkylamine
+CCNC1(c2cccc(OC)c2)CCCCC1=O	MXE	arylcycloalkylamine
+CCOC(=O)CCCN(C)C1(c2ccccc2Cl)CCCCC1=O	Et-KE-Bu	arylcycloalkylamine
+CCNC1(c2ccccc2)CCCCC1	PCE	arylcycloalkylamine
+c1cc2c(cc1C1(N3CCOCC3)CCCCC1)OCO2	3,4-MD-PCMo	arylcycloalkylamine
+OCCNC1(c2ccccc2)CCCCC1	PCEOH	arylcycloalkylamine
+c1ccc(C2(N3CCCCC3)CCCCCCC2)cc1	PCOP	arylcycloalkylamine
+COc1ccc(C2(N3CCCCC3)CC3CCC2C3)cc1	4-MeO-PBCHP	arylcycloalkylamine
+COc1cccc(C2(N3CCCCC3)CCCc3ccccc32)c1	1-[1-(3-Methoxyphenyl)-1,2,3,4-tetrahydronaphthalen-1-yl]piperidine	arylcycloalkylamine
+CCNC12CCCCC1CCc1ccccc12	N-Ethyl-1,3,4,9,10,10a-hexahydrophenanthren-4a(2H)-amine	arylcycloalkylamine
+c1ccc([C@]2(N3CCCCC3)C[C@H]3C[C@H]3C2)cc1	1-[(1R,3r,5S)-3-Phenylbicyclo[3.1.0]hexan-3-yl]piperidine	arylcycloalkylamine
+c1ccc(C2(N3CCCCC3)CN3CCC2CC3)cc1	P3QP	arylcycloalkylamine
+COc1cccc(C2(N3CCCC3)CCCCC2=O)c1	3-MeO-2'-Oxo-PCPy	arylcycloalkylamine
+c1cc2c(cc1C1(N3CCCCC3)CCCCC1)OCCO2	3,4-ED-PCP	arylcycloalkylamine
+NC1(c2ccccc2Cl)CCCNC1=O	3-Amino-3-(2-chlorophenyl)piperidin-2-one	arylcycloalkylamine
+CC[C@]1(c2ccccc2)OC[C@H]([C@@H]2CCCCN2)O1	CL-1848C	arylcycloalkylamine
+O=[N+]([O-])c1cccc(C2(N3CCCCC3)CCCCC2)c1	3-NO2-PCP	arylcycloalkylamine
+Fc1cccc(C2(N3CCCCC3)CCCCCC2)c1	3F-PCHEP	arylcycloalkylamine
+CCNC1(c2cccc(OC(C)C)c2)CCCCC1=O	iPXE	arylcycloalkylamine
+COc1cc(C2(N3CCCCC3)CCCCC2)ccc1C	3-MeO-4-Me-PCP	arylcycloalkylamine
+O=C1CCC(c2ccccc2)(N2CCCCC2)CC1	4'-Oxo-PCP	arylcycloalkylamine
+CCNC1(c2ccc3c(c2)OCO3)CCCCC1	3,4-MD-PCE	arylcycloalkylamine
+CNC1(c2ccccc2OC)CCCCC1=O	2-MDCK	arylcycloalkylamine
+CCOc1cccc(C2(N3CCCCC3)CCCCC2)c1	3-EtO-PCP	arylcycloalkylamine
+CNC1(c2ccccc2C)CCCCC1=O	o-MDCK	arylcycloalkylamine
+CNC1(c2cccc(Cl)c2)CCCCC1=O	meta-Ketamine	arylcycloalkylamine
+CCNC1(c2cc(OC)ccc2Br)CCCCC1=O	Bromo-methoxetamine	arylcycloalkylamine
+CNC1(c2cccc(OC)c2)CCCCC1=O	MXM	arylcycloalkylamine
+CCCOC(=O)CCNC1(c2ccccc2Cl)CCCCC1=O	nPr-NKE-Et	arylcycloalkylamine
+CC1CCCCC1(c1ccccc1)N1CCCCC1	2'-Me-PCP	arylcycloalkylamine
+Cc1ccc(C2(N3CCC(O)CC3)CCCCC2O)cc1	2',4″-HO-4-Me-PCP	arylcycloalkylamine
+NC1(c2ccccc2Cl)CCC(O)CC1=O	(2,5)-HNK	arylcycloalkylamine
+Fc1cccc(C2(N3CCCCC3)CC3CCC2C3)c1	3F-PBCHP	arylcycloalkylamine
+CC(C)NC1(c2ccccc2)CCCCC1	PCiP	arylcycloalkylamine
+Fc1ccc(C2(N3CCCCC3)CCCCCC2)cc1	4F-PCHEP	arylcycloalkylamine
+CCCNC1(c2ccccc2)CCCC1	PCPEPr	arylcycloalkylamine
+CC(C)Oc1cccc(C2(N)CCCCC2)c1	3-IpO-PCA	arylcycloalkylamine
+CC(O)CNC1(c2ccccc2)CCCCC1	1-[(1-Phenylcyclohexyl)amino]propan-2-ol	arylcycloalkylamine
+Cc1ccc(C2(N(C)C)CCC(O)(CCc3ccccc3)CC2)cc1	MDPC	arylcycloalkylamine
+Cc1cc(O)ccc1C1(N2CCOCC2)CCCCC1	4-HO-2-Me-PCMo	arylcycloalkylamine
+O=C1CCCCC1(c1ccccc1)N1CCCC1	2-Phenyl-2-(pyrrolidin-1-yl)cyclohexan-1-one	arylcycloalkylamine
+CNC1(c2ccccc2Cl)CCCCCC1=O	2-(2-Chlorophenyl)-2-(methylamino)cycloheptan-1-one	arylcycloalkylamine
+CCN(CC)C1(c2ccccc2)CCCCC1	PCDE	arylcycloalkylamine
+COc1cccc([C@@]2(O)CCN(C3(c4ccccc4)CCCCC3)C[C@@H]2CN(C)C)c1	US 7049327 #6	arylcycloalkylamine
+Cc1cccc(C2(N3CCCC3)CC3CCC2C3)c1	3-Me-PBCHPy	arylcycloalkylamine
+C#Cc1ccc2c(c1)C(c1ccccc1F)=N[C@@H](C)c1c(C(=O)N(C)C)ncn1-2	GL-i-54	aryldiazepine
+O=C1CN=C(c2c(F)cccc2F)c2cc(Cl)ccc2N1	Ro-07-3953	aryldiazepine
+O=C1CN=C(c2ccn[nH]2)c2cc(Cl)ccc2N1	SCHEMBL9684958	aryldiazepine
+C#Cc1ccc2c(c1)C(c1ccccn1)=NCc1c(C(N)=O)ncn1-2	MP-ii-065	aryldiazepine
+CN1C(=O)CN=C(c2ccccc2F)c2c(Cl)cccc21	Ro-13-0699	aryldiazepine
+C#Cc1ccc2c(c1)C(c1ccccc1)=NCc1c(C(=O)OCC(F)(F)F)ncn1-2	DM-ii-20	aryldiazepine
+O=C1OCCC2N=C(c3ccccc3)c3ccccc3-n3cnc1c32	8-Phenyl-6,6a-dihydro-4-oxa-2,7,12b-triazabenzo[b]cyclopenta[kl]heptalen-3(5H)-one	aryldiazepine
+CCC1C(C)=NN=C(c2ccc(OC)c(OC)c2)c2cc(OC)c(OC)cc21	Tofisopam	aryldiazepine
+CN1C(=O)CN=C(c2ccc(F)cc2)c2cc(Cl)ccc21	4F-Diazepam	aryldiazepine
+CC(C)COC(=O)c1ncn2c1C1CCCN1C(=O)c1c(Cl)cccc1-2	Ro-16-7082	aryldiazepine
+CN1C(=O)CN=C(c2cccs2)c2cc(Cl)ccc21	WZ-113	aryldiazepine
+CC(=O)c1ccc2c(c1)C(c1ccccc1)=NCC(=O)N2	Ro-20-3053	aryldiazepine
+C#Cc1ccc2c(c1)C(=O)N(C)Cc1c(C(=O)OC(C)(C)C)ncn1-2	RY-24	aryldiazepine
+CC(C)(C)OC(=O)c1ncn2c1C1CCCN1C(=O)c1c(F)cccc1-2	Ro-16-8912	aryldiazepine
+O=C1CN=C(c2ccccc2F)c2cc(Cl)ccc2N1CCO	Ro-07-2750	aryldiazepine
+CN1C(=O)CN=C(c2ccccc2Cl)c2cc([N+](=O)[O-])ccc21	Ro-05-4082	aryldiazepine
+Cc1nnc2n1-c1sc(Cl)cc1C(c1ccccc1)=NC2	Deschloroclotizolam	aryldiazepine
+CCOC(=O)c1ncn2c1C(C)N=C(c1ccc(F)cc1)c1cc(F)ccc1-2	Ethyl 8-fluoro-6-(4-fluorophenyl)-4-methyl-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate	aryldiazepine
+O=C1CN=C(c2ccccc2F)c2cc(Cl)c(Cl)cc2N1	Ro-20-8065	aryldiazepine
+CN1C(=O)CN=C(c2c(F)cccc2F)c2cc(Br)ccc21	Ro-13-3780	aryldiazepine
+CN1C(=O)CC(=O)N(c2ccccc2)c2cc(Cl)ccc21	Clobazam	aryldiazepine
+OCc1nnc2n1-c1ccc(Cl)cc1C(c1ccccc1)=NC2	alpha-Hydroxyalprazolam	aryldiazepine
+O=C1Nc2ccc(Cl)cc2C(c2ccccc2)=NC1O	Oxazepam	aryldiazepine
+CCOC(=O)c1ncn2c1CN=C(c1ccc([N+](=O)[O-])cc1)c1ccccc1-2	Ro-23-2896	aryldiazepine
+CN1C(=O)CN=C(c2ccccc2F)c2cc(Br)ccc21	Flubrometazepam	aryldiazepine
+CN(C)C(=O)c1nc2n(n1)-c1ccc(Cl)cc1C(c1ccccc1Cl)=NC2	Rilmazolam	aryldiazepine
+CC1N=C(c2ccccc2F)c2cc(Cl)ccc2NC1=O	Ro-11-4878	aryldiazepine
+CCOC(=O)c1ncn2c1C1CCCN1C(=O)c1cc(Br)ccc1-2	RY-054	aryldiazepine
+CCOC(=O)c1ncn2c1C1CCN1C(=O)c1c(Cl)cccc1-2	Ro-16-0858	aryldiazepine
+CN1C(=O)CN=C(c2ccc(Cl)cc2)c2cc(Cl)ccc21	Ro-05-4864	aryldiazepine
+CN(C)CCc1nnc2n1-c1ccc(Cl)cc1C(c1ccccc1)=NC2	U-43465F	aryldiazepine
+CN1C(=O)CN=C(c2ccccc2F)c2c(Cl)cc(Cl)cc21	Ro-13-0882	aryldiazepine
+CCc1ccc2c(c1)C(c1ccccc1)=NCC(=O)N2	Ro-20-2533	aryldiazepine
+CCOC(=O)c1ncn2c1CC=C(c1ccccc1F)c1ccccc1-2	Ro-15-2200	aryldiazepine
+O=C1CC=C(c2ccccc2Cl)c2cc([N+](=O)[O-])ccc2N1	Ro-15-8867	aryldiazepine
+Cc1cc2c(cc1Cl)NC(=O)CN=C2c1ccccc1F	Ro-20-8552	aryldiazepine
+N#Cc1ncn2c1CN=C(c1ccc(Cl)cc1)c1cc(Cl)ccc1-2	8-Chloro-6-(4-chlorophenyl)-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carbonitrile	aryldiazepine
+CC(C)c1nc(-c2ncn3c2CN(C)C(=O)c2c(Cl)cccc2-3)no1	FG-8205	aryldiazepine
+Cc1nnc2n1-c1ccc([N+](=O)[O-])cc1C(c1ccccc1Cl)=NC2	Clonazolam	aryldiazepine
+O=C1CN=C(c2ccccc2[N+](=O)[O-])c2cc(Br)ccc2N1	QH-II-067a	aryldiazepine
+NC(=O)c1ncn2c1CC=C(c1ccccc1F)c1cc(Cl)ccc1-2	Ro-14-3930	aryldiazepine
+COC(=O)CC[C@@H]1N=C(c2ccccn2)c2cc(Br)ccc2-n2c(C)cnc21	CNS-7056	aryldiazepine
+CN1C(=O)CN=C(C2CCC2)c2cc(F)ccc21	5-Cyclobutyl-7-fluoro-1-methyl-1,3-dihydro-2H-1,4-benzodiazepin-2-one	aryldiazepine
+O=C1CN=C(c2c(F)cccc2Cl)c2cc(Cl)ccc2N1	Ro-07-5193	aryldiazepine
+CN1C(=O)CN=C(c2ccccc2F)c2cc(I)ccc21	Ro-07-9957	aryldiazepine
+O=C1CN=C(c2ccccc2)c2cc(Cl)ccc2N1CC1CC1	Prazepam	aryldiazepine
+CCOC(=O)c1ncn2c1CN=C(c1cccc([N+](=O)[O-])c1)c1cc(F)ccc1-2	Ethyl 8-fluoro-6-(3-nitrophenyl)-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate	aryldiazepine
+Clc1ccc2c(c1)-c1ncnn1Cc1c(Cl)ncn1-2	Ro4882224	aryldiazepine
+[N-]=[N+]=Nc1ccc2c(c1)C(c1ccccc1F)=NCC(=O)N2	Ro-14-3074	aryldiazepine
+Fc1ccccc1C1=NCC=Cc2ccc(Cl)cc21	Ro-22-1274	aryldiazepine
+Nc1ncc2c(n1)-c1ccc(Cl)cc1C(c1ccccc1F)=NC2	Ro-22-2038	aryldiazepine
+Clc1ccc2c(c1)C(c1ccccc1)=NCc1nncn1-2	Estazolam	aryldiazepine
+Cc1nn(C)c2c1C(c1ccccc1F)=NCC(=O)N2C	Zolazepam	aryldiazepine
+Cc1nnc2n1-c1ccc(Cl)cc1C(c1ccccn1)=NC2	Pyclazolam	aryldiazepine
+S=C1CN=C(c2ccccc2)c2cc(Cl)ccc2N1	Thionordazepam	aryldiazepine
+O=C1CN=C(c2ccccc2)c2cc(Cl)ccc2N1CC(F)(F)F	Halazepam	aryldiazepine
+C#Cc1ccc2c(c1)C(c1ccccc1)=NCC1=N/C(=C\N3CCN(C)CC3)C(=O)N12	PS-i-37	aryldiazepine
+C#Cc1ccc2c(c1)C(c1ccccc1F)=NCc1c(C(=O)OCC(F)(F)F)ncn1-2	JY-i-59	aryldiazepine
+O=C1CN=C(c2ccccc2F)c2cc([N+](=O)[O-])ccc2N1	Fonazepam	aryldiazepine
+CN1CCN(/C=C2\N=C3CN=C(c4ccccc4)c4cc(Br)ccc4N3C2=O)CC1	PS-1-35	aryldiazepine
+CCCCCCC(C)(C)c1ccc([C@@H]2CCC[C@H](O)C2)c(O)c1	(1R,3S) CP 47,497	cannabinoid
+CCCc1ccc(C(=O)c2cn(CCCCCF)c3ccccc23)c2ccccc12	SGT-62	cannabinoid
+CC(C)[C@H](NC(=O)c1cn(Cc2ccc(F)cc2)c2ccccc12)C(N)=O	AB-FUBICA	cannabinoid
+CCCCCn1nc(C(=O)N[C@@H](Cc2ccccc2)C(=O)OC)c2ccccc21	MPP-PINACA	cannabinoid
+O=C(Cc1cn(Cc2ccc(F)cc2)c2ccccc12)NC1C2CC3CC(C2)CC1C3	AFUBIATA	cannabinoid
+CC(C)(C)c1nc(N2CCC(F)(F)C2)c2nnn(Cc3ccccc3S(C)(=O)=O)c2n1	5-tert-Butyl-7-(3,3-difluoropyrrolidin-1-yl)-3-{[2-(methanesulfonyl)phenyl]methyl}-3H-[1,2,3]triazolo[4,5-d]pyrimidine	cannabinoid
+CCC(C(N)=O)N(C)C(=O)c1nn(Cc2ccc(F)cc2)c2ccccc12	AB-FUBINACA isomer 5	cannabinoid
+COc1cccc2c3c(=O)n([C@@H]4C(C)(C)[C@@H]5CC[C@@]4(C)C5)ccc3n(Cc3ccncc3)c12	WO 2001/058869 #190	cannabinoid
+CCCC(F)Cn1cc(C(=O)C2C(C)(C)C2(C)C)c2ccccc21	(2-Fluoropentyl) XLR-11	cannabinoid
+O=C(Nc1ccccc1)c1cn(CCCCCF)c2ccccc12	LTI-701	cannabinoid
+C=CCCCn1nc(C(=O)N[C@H](C(=O)OC)C(C)C)c2ccccc21	MMB-4en-PINACA	cannabinoid
+O=C(Nc1ccccc1)c1nn(CC2CCOCC2)c2ccccc12	SGT-224	cannabinoid
+Cc1ccc(C(=O)NC(C)(C)c2ccccc2)cc1S(=O)(=O)N1CCC(F)(F)CC1	SGT-233	cannabinoid
+CCCCCn1nc(C(=O)c2ccc(OC)c3ccccc23)c2ccccc21	SGT-35	cannabinoid
+CC1(C)C(C(=O)c2cn(CC3CCCCC3)c3ccccc23)C1(C)C	(CHM) UR-144	cannabinoid
+CN1CCCCC1Cn1cc(C(=O)c2ccc(N=C=S)c3ccccc23)c2ccc(N=C=S)cc21	AM-2215	cannabinoid
+CCCCCCC1(c2ccc(-c3cc(C)cc(C)c3)c(O)c2)CC1	4-(1-Hexylcyclopropyl)-3',5'-dimethyl[1,1'-biphenyl]-2-ol	cannabinoid
+COC(=O)[C@@H](NC(=O)c1cn(Cc2ccc(F)cc2)c2ncccc12)C(C)(C)C	MDMB-FUB7AICA	cannabinoid
+CN1CCCCC1Cn1cc(C(=O)c2ccccc2I)c2ccccc21	AM-2233	cannabinoid
+O=C(c1cccc2ccccc12)n1c(-c2ccncc2)nc2ccccc21	(Naphthalen-1-yl)[2-(pyridin-4-yl)-1H-benzimidazol-1-yl]methanone	cannabinoid
+C=CCCCn1nc(C(=O)N[C@H](C(=O)OC)C(C)(C)C)c2ccccc21	MDMB-4en-PINACA	cannabinoid
+Oc1ccc(/C=C2\C=C(CCN3CCOCC3)c3ccccc32)c2ccccc12	US 5292736 #19	cannabinoid
+CCc1c(C(=O)NN2CCCCC2)nn(-c2ccc(Cl)cc2Cl)c1-c1ccc(C#Cc2ccc(C(F)(F)F)cc2)s1	TM-38837	cannabinoid
+COC(=O)[C@H](Cc1ccccc1)NC(=O)c1cn(CCCCCF)c2ccccc12	MPHP-2201	cannabinoid
+Cc1ccc2c(C(C[N+](=O)[O-])c3ccccc3)c(-c3ccccc3)[nH]c2c1	GAT211	cannabinoid
+CCCCCn1nc(C(=O)NC2CCCCC2)c2ccccc21	SGT-85	cannabinoid
+CN1CCCCC1Cn1cc(C(=O)c2ccc([N+](=O)[O-])c3ccccc23)c2ccccc21	AM-1299	cannabinoid
+CCc1c(C)cc(C(=O)NC2(C(=O)O)CCCCC2)c(=O)n1Cc1ccc(F)cc1	S-777469	cannabinoid
+CCCCCC(C)NC(=O)c1nn(CCCCC)c2ccccc12	SGT-71	cannabinoid
+CC1(C)Oc2cc(C34CC5CC(CC(C5)C3)C4)cc(O)c2[C@@H]2CC(O)CC[C@H]21	(6aR,10aR)-3-(Adamantan-1-yl)-6,6-dimethyl-6a,7,8,9,10,10a-hexahydro-6H-dibenzo[b,d]pyran-1,9-diol	cannabinoid
+C=C(C)[C@H]1CCC(CO)=C[C@@H]1c1c(O)cc(C(C)(C)CCCCN2CCOCC2)cc1O	(1'S,2'S)-5'-(Hydroxymethyl)-4-[2-methyl-6-(morpholin-4-yl)hexan-2-yl]-2'-(prop-1-en-2-yl)-1',2',3',4'-tetrahydro[1,1'-biphenyl]-2,6-diol	cannabinoid
+O=C(N/N=C1\C(=O)N(CCCCCF)c2ccccc21)c1ccccc1	BZO-5F-POXIZID	cannabinoid
+CCCCCOc1c(OC)ccc2cc(C(=O)NCc3ccc4c(c3)OCO4)c(=O)[nH]c12	JTE-907	cannabinoid
+CCCCn1nc(C(=O)N[C@@H](Cc2ccccc2)C(=O)OC)c2ccccc21	MPP(N)-073	cannabinoid
+CCCCCCC(C)(C)c1ccc([C@@H]2CCC[C@@H](O)C2)c(O)c1	(R,R)-epi-CP 47,497	cannabinoid
+CCCCCOc1ccc(C(=O)c2cccc3ccccc23)c2ccccc12	CB-13	cannabinoid
+COc1ccccc1OC(=O)c1ccc(C)c(S(=O)(=O)N2CCOCC2)c1	2-Methoxyphenyl 4-methyl-3-(morpholine-4-sulfonyl)benzoate	cannabinoid
+CCCCCC#Cc1cc(O)c2c(c1)OC(C)(C)[C@@H]1CC=C(C)C[C@@H]21	AMG-1	cannabinoid
+CC(C)[C@H](NC(=O)c1cn(CCCCCF)c2ccccc12)C(N)=O	5F-ABICA	cannabinoid
+CCCCCn1cc(C(=O)NC23CC4CC(CC(C4)C2)C3)c(=O)c2ccc(F)cc21	N-(Adamantan-1-yl)-7-fluoro-4-oxo-1-pentyl-1,4-dihydroquinoline-3-carboxamide	cannabinoid
+CC1=CC[C@@H]2[C@@H](C1)c1c(O)cc(C(C)(C)CCCCCC#N)cc1OC2(C)C	O-774	cannabinoid
+CC(C)(C)[C@H](NC(=O)n1c(=O)n(CCN2CCOCC2)c2ccccc21)C(N)=O	WO 2008/032164 #4	cannabinoid
+COC(=O)[C@H](Cc1ccccc1)NC(=O)c1cn(CC2CCCCC2)c2ccccc12	MPP-CHMICA	cannabinoid
+Fc1ccc2nc(-c3ccccn3)n(Cc3cccc4ccccc34)c2c1	6-Fluoro-1-[(naphthalen-1-yl)methyl]-2-(pyridin-2-yl)-1H-benzimidazole	cannabinoid
+CCCCCn1cc(C(=O)N[C@@H](C)c2ccccc2)c2ccccc21	1-Pentyl-N-[(1S)-1-phenylethyl]-1H-indole-3-carboxamide	cannabinoid
+CCCCCCCC(C)c1cc(OC(=O)CCCN(CC)CC)c2c(c1)OC(C)(C)C1=C2CC(C)CC1	SP-325	cannabinoid
+CCCCCn1cc(C(=O)c2cccc3ccccc23)cc1-c1cccc(C)c1	JWH-346	cannabinoid
+O=C(Cc1ccccc1)N/N=C1\C(=O)N(CC2CCCCC2)c2cc(OCCN3CCOCC3)ccc21	N'-{1-(Cyclohexylmethyl)-6-[2-(morpholin-4-yl)ethoxy]-2-oxo-1,2-dihydro-3H-indol-3-ylidene}-2-phenylacetohydrazide	cannabinoid
+Cc1c(C(=O)C2C(C)(C)C2(C)C)c2ccccc2n1CCCCCF	2-Me-XLR-11	cannabinoid
+COc1ccc2c(c1)CCC2CNC(=O)c1cn(CCCCCF)c2ccccc12	SGT-105	cannabinoid
+CCCCCc1cc(O)c2c(c1)OC(C)(C)C(CCC(C)=O)C2=O	CBCN	cannabinoid
+CCCCCn1nc(C(=O)NC(C)(C)c2ccc(F)cc2)c2ccccc21	SGT-60	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1nn(CC2CCCCCC2)c2ccccc12)C(=O)NCCO	WO 2009/106980 #433	cannabinoid
+CC(C)(NC(=O)c1cn(Cc2ccc(F)cc2)c2ccccc12)c1ccccc1	CUMYL-FUBICA	cannabinoid
+COC(=O)[C@@H](NC(=O)c1nn(CC2CCCCC2)c2ccccc12)C(C)(C)C	MDMB(N)-CHM	cannabinoid
+CCCCCn1nc(C(=O)c2cccc3ccccc23)c2ccccc21	SGT-17	cannabinoid
+CCCCCn1cc(C(=O)N[C@H](C(N)=O)C(C)(C)C)c2ccccc21	ADBICA	cannabinoid
+CN1CCCCC1Cn1cc(C(=O)c2cc(N=C=S)ccc2I)c2ccc(N=C=S)cc21	AM-2223	cannabinoid
+CCCCCCCCCn1cc(C(=O)c2cccc3ccccc23)c2ccccc21	(Nonyl) JWH-018	cannabinoid
+CCCCCCC(C)(C)c1cc(OC)c([C@@H]2C=C(CO)C3CC2C3(C)C)c(OC)c1	HU-433	cannabinoid
+C=CCc1cc(OC)c(OC)c(OC)c1OC	2,3,4,5-Tetramethoxyphenylprop-2-ene	essential oil
+C/C=C\c1ccc(O)c(OC)c1	cis-4-Hydroxy-3-methoxyphenylprop-1-ene	essential oil
+C/C=C/c1ccc2c(c1OC)OCO2	Isocroweacin	essential oil
+C/C=C\c1cc(OC)c(O)c(OC)c1	cis-4-Hydroxy-3,5-dimethoxyphenylprop-1-ene	essential oil
+C=CCc1ccc2c(c1OC)OCO2	Croweacin	essential oil
+C/C=C\c1cc2c(cc1OC)OCO2	cis-2-Methoxy-4,5-methylenedioxyphenylprop-1-ene	essential oil
+C=CCc1ccc2c(c1)OCO2	Safrole	essential oil
+C/C=C\c1cc(OC)c2c(c1)OCO2	cis-Isomyristicin	essential oil
+C/C=C\c1ccc(OC)cc1OC	cis-2,4-Dimethoxyphenylprop-1-ene	essential oil
+C/C=C\c1ccc2c(c1OC)OCO2	cis-2-Methoxy-3,4-methylenedioxyphenylprop-1-ene	essential oil
+C/C=C/c1ccc(OC)c(OC)c1	Methylisoeugenol	essential oil
+C=CCc1ccc(OC)cc1OC	Osmorrhizole	essential oil
+C=CCc1ccc(OC)c(OC)c1	Methyleugenol	essential oil
+C=CCc1ccc(O)c(OC)c1	Eugenol	essential oil
+C=CCc1cc2c(c(OC)c1OC)OCO2	Dillapiole	essential oil
+C/C=C\c1ccc2c(c1)OCO2	alpha-Isosafrole	essential oil
+C/C=C/c1cc(OC)c(OC)c(OC)c1	Isoelemicin	essential oil
+C=CCc1ccc(OC)c(O)c1	Chavibetol	essential oil
+C=CCc1cc(OC)c(OC)c(OC)c1	Elemicin	essential oil
+C=CCc1cc(OC)cc(OC)c1	3,5-Dimethoxyphenylprop-2-ene	essential oil
+C/C=C\c1cc(OC)c(OC)c(OC)c1	cis-Isoelemicin	essential oil
+C/C=C/c1cc(OC)c(OC)c(OC)c1OC	trans-2,3,4,5-Tetramethoxyphenylprop-1-ene	essential oil
+C/C=C/c1cc(OC)c2c(c1OC)OCO2	Isoapiole	essential oil
+C/C=C\c1ccc(OC)c(O)c1	cis-3-Hydroxy-4-methoxyphenylprop-1-ene	essential oil
+C=CCc1ccc(OC)cc1	Estragole	essential oil
+C/C=C\c1cc(OC)c2c(c1OC)OCO2	cis-2,5-Dimethoxy-3,4-methylenedioxyphenylprop-1-ene	essential oil
+C=CCc1cc(OC)c2c(c1OC)OCO2	Apiole	essential oil
+C/C=C/c1ccc(OC)cc1OC	Nothosmyrnol	essential oil
+C/C=C/c1cc(OC)cc(OC)c1	trans-3,5-Dimethoxyphenylprop-1-ene	essential oil
+C/C=C\c1cc2c(c(OC)c1OC)OCO2	cis-2,3-Dimethoxy-4,5-methylenedioxyphenylprop-1-ene	essential oil
+C/C=C\c1ccc(OC)cc1	cis-4-Methoxyphenylprop-1-ene	essential oil
+C/C=C/c1cc(OC)c(O)c(OC)c1	2,6-Dimethoxy-4-[(1E)-prop-1-en-1-yl]phenol	essential oil
+C=CCc1cc(OC)c(OC)cc1OC	γ-Asarone	essential oil
+C/C=C/c1ccc(OC)cc1	Anethole	essential oil
+C=CCc1cc2c(cc1OC)OCO2	Asaricin	essential oil
+C/C=C/c1cc2c(c(OC)c1OC)OCO2	Isodillapiole	essential oil
+C/C=C/c1cc(OC)c(OC)cc1OC	Asarone	essential oil
+C/C=C/c1ccc(O)c(OC)c1	Isoeugenol	essential oil
+C/C=C\c1cc(OC)cc(OC)c1	cis-3,5-Dimethoxyphenylprop-1-ene	essential oil
+C/C=C\c1cc(OC)c(OC)cc1OC	beta-Asarone	essential oil
+C=CCc1cc(OC)c2c(c1)OCO2	Myristicin	essential oil
+C/C=C/c1ccc(OC)c(O)c1	2-Methoxy-5-[(1E)-prop-1-en-1-yl]phenol	essential oil
+C/C=C/c1cc(OC)c2c(c1)OCO2	Isomyristicin	essential oil
+C/C=C\c1ccc(OC)c(OC)c1	cis-3,4-Dimethoxyphenylprop-1-ene	essential oil
+C=CCc1cc(OC)c(O)c(OC)c1	5-Methoxyeugenol	essential oil
+C/C=C/c1ccc2c(c1)OCO2	beta-Isosafrole	essential oil
+C/C=C\c1cc(OC)c(OC)c(OC)c1OC	cis-2,3,4,5-Tetramethoxyphenylprop-1-ene	essential oil
+C/C=C/c1cc2c(cc1OC)OCO2	Carpacin	essential oil
+CCC(=O)N(c1ccccc1)C1(COC)CCN(CC(O)c2cccs2)CC1	beta-Hydroxy-sufentanil	fentanyl
+CCC(=O)N(CCc1ccccc1)C1CCN(CCc2ccccc2)CC1	(ethylene) Fentanyl	fentanyl
+CCC(=O)N(c1ccccc1F)C1(c2ccccc2)CCN(CCn2cccn2)CC1	N-(2-Fluorophenyl)-N-{4-phenyl-1-[2-(1H-pyrazol-1-yl)ethyl]piperidin-4-yl}propanamide	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(C(C)Cc2cc(OC)c(I)cc2OC)CC1	N-(DOI) fentanyl	fentanyl
+CCC(=O)N(c1ccccc1)C1(COC(=O)C(C)(C)C)CCN(CCN2C(=O)c3ccccc3C2=O)CC1	{1-[2-(1,3-Dioxo-1,3-dihydro-2H-isoindol-2-yl)ethyl]-4-[phenyl(propanoyl)amino]piperidin-4-yl}methyl 2,2-dimethylpropanoate	fentanyl
+CC(C)C(=O)N(c1cccc(F)c1)C1CCN(CCc2ccccc2)CC1	m-Fluoro-isobutyrylfentanyl	fentanyl
+CCCC(=O)N(c1ccc(OC)cc1)C1CCN(CCc2ccccc2)CC1	p-MeO-BF	fentanyl
+CCC(=O)N(c1ccccc1)C1(C(=O)OC)CCN(Cc2ccccc2)CC1	Benzylcarfentanil	fentanyl
+CCC(=O)N(c1ccccc1)C1(C(=O)OC)CCN(CCc2ccsc2)CC1	Methyl 4-[phenyl(propanoyl)amino]-1-[2-(thiophen-3-yl)ethyl]piperidine-4-carboxylate	fentanyl
+COCC(=O)N(c1ccc(C)cc1)C1CCN(CCc2ccccc2)CC1	p-Methyl-methoxyacetylfentanyl	fentanyl
+CCCCC(=O)N(c1ccc(OC)cc1)C1CCN(CCc2ccccc2)CC1	p-Methoxy-valerylfentanyl	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CCc2ccccc2)CC1F	NFEPP	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(C(C)Cc2cc(OC)c(Br)cc2OC)CC1	N-(DOB) fentanyl	fentanyl
+CCCC(=O)N(c1ccccc1)C1CCN(C)CC1	N-Methyl-butyrylfentanyl	fentanyl
+O=C(c1ccco1)N(c1ccccc1)C1CCN(CCc2ccc(O)cc2)CC1	4'-Hydroxy-furanylfentanyl	fentanyl
+CCC(=O)OCC1(N(C(=O)CC)c2ccccc2)CCN(CCN2C(=O)c3ccccc3C2=O)CC1	{1-[2-(1,3-Dioxo-1,3-dihydro-2H-isoindol-2-yl)ethyl]-4-[phenyl(propanoyl)amino]piperidin-4-yl}methyl propanoate	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CCc2ccccc2)C(C)C1	2-Methylfentanyl	fentanyl
+CC(=O)N(c1ccccc1)C1CCN(CCCc2ccccc2)CC1	Phenylpropyl-acetyl-norfentanyl	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CCOc2ccccc2)CC1	POE-F	fentanyl
+O=C(c1ccco1)N(c1ccccc1)C1CCNCC1	Furanyl-norfentanyl	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(Cc2ccccc2)CC1	R-4129	fentanyl
+Cc1ccc(NC2CCN(CCc3ccccc3)CC2)cc1	p-Me-4-ANPP	fentanyl
+CCC(=O)N(c1ccccc1)C1(C(=O)O)CCN(CCc2ccccc2)C(O)C1	2-Hydroxycarfentanil acid	fentanyl
+COCC(=O)N(c1ccc(F)cc1)C1CCN(CCc2ccccc2)CC1	p-Fluoro-methoxyacetylfentanyl	fentanyl
+Cc1cccc(N(C(=O)c2ccco2)C2CCN(CCc3ccccc3)CC2)c1	m-Methyl-furanylfentanyl	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CCc2ccccc2F)CC1	2″-Fluorofentanyl	fentanyl
+COc1ccccc1N(C(=O)c1ccco1)C1CCN(CCc2ccccc2)CC1	o-Methoxy-furanylfentanyl	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CC(O)c2ccc(F)cc2)CC1	N-{1-[2-(4-Fluorophenyl)-2-hydroxyethyl]piperidin-4-yl}-N-phenylpropanamide	fentanyl
+CC(=O)N(c1ccccc1)C1CCN(CCc2cccs2)CC1	Acetylthiofentanyl	fentanyl
+COCC(=O)N(c1cccc(F)c1)C1CCN(CCc2ccccc2)CC1	m-Fluoro-methoxyacetylfentanyl	fentanyl
+COc1cc(CCN2CCC(N(C(=O)C(=O)CCC(=O)O)c3ccccc3)CC2)ccc1O	N-Phenyl-N-[1-(2-phenylethyl)piperidin-4-yl]-2-oxo-4-carboxybutanamide	fentanyl
+CCC(=O)N(c1ccccc1)C1(COC)CCN(CCn2nnn(CC)c2=O)CC1	R-39209	fentanyl
+CCC(=O)N(c1ccc(Cl)cc1)C1CCN(CCc2ccccc2)CC1	p-CF	fentanyl
+CCC(=O)N(c1ccccc1)C1CCNCC1	Norfentanyl	fentanyl
+COC(=O)CCN1CCC(Nc2ccccc2)(C(=O)OC)CC1	Despropionyl remifentanil	fentanyl
+CCC(=O)N(c1ccccc1)C1(c2nc(C)cs2)CCN(CCc2ccccc2)CC1	N-[4-(4-Methyl-1,3-thiazol-2-yl)-1-(2-phenylethyl)piperidin-4-yl]-N-phenylpropanamide	fentanyl
+CCC(=O)N(c1ccccc1)C1(c2ccccc2)CCN(CCc2ccccc2)CC1	4-Phenylfentanyl	fentanyl
+CCC(=O)N(c1ccccc1C)C1CCN(CCc2ccccc2)CC1	o-Methylfentanyl	fentanyl
+CCC(=O)N(c1ccccc1)C1(C(=O)OC)CCN(CCCCCF)CC1	Fluoropentyl-norcarfentanil	fentanyl
+O=C(c1ccco1)N(c1ccccc1)C1CCN(Cc2ccccc2)CC1	Furanylbenzylfentanyl	fentanyl
+CCC(=O)N(c1ccc2ncoc2c1)C1CCN(CCc2ccccc2)CC1	N-Benzoxazolyl-fentanyl	fentanyl
+COCC(=O)N(c1cccc(C)c1)C1CCN(CCc2ccccc2)CC1	m-Methyl-methoxyacetylfentanyl	fentanyl
+CC(C)C(=O)OCC1(N(C(=O)C(C)C)c2ccccc2)CCN(CCN2C(=O)c3ccccc3C2=O)CC1	{1-[2-(1,3-Dioxo-1,3-dihydro-2H-isoindol-2-yl)ethyl]-4-[(2-methylpropanoyl)(phenyl)amino]piperidin-4-yl}methyl 2-methylpropanoate	fentanyl
+CCC(=O)N(c1ccccc1)C1(C(=O)OC)CCN(CCc2ccccn2)CC1	Methyl 4-[phenyl(propanoyl)amino]-1-[2-(pyridin-2-yl)ethyl]piperidine-4-carboxylate	fentanyl
+c1ccc(CCN2CCC(Nc3ccccc3)CC2)cc1	ANPP	fentanyl
+CCCc1cc(OC)c(CCN2CCC(N(C(=O)CC)c3ccccc3)CC2)cc1OC	N-(2C-P) fentanyl	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CC(O)c2ccncc2)CC1C	N-{1-[2-Hydroxy-2-(pyridin-4-yl)ethyl]-3-methylpiperidin-4-yl}-N-phenylpropanamide	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CC(=O)c2cccc(F)c2)CC1	N-{1-[2-(3-Fluorophenyl)-2-oxoethyl]piperidin-4-yl}-N-phenylpropanamide	fentanyl
+CCCCc1cc(OC)c(CC(C)N2CCC(N(C(=O)CC)c3ccccc3)CC2)cc1OC	N-(DOBU) fentanyl	fentanyl
+COCC(=O)N(c1ccccc1)C1C(C)CN(CCn2cccn2)CC1C	N-{3,5-Dimethyl-1-[2-(1H-pyrazol-1-yl)ethyl]piperidin-4-yl}-2-methoxy-N-phenylacetamide	fentanyl
+Cc1ccc(N(C(=O)C2CCCO2)C2CCN(CCc3ccccc3)CC2)cc1	p-Methyl-tetrahydrofuranylfentanyl	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CCc2cc(OC)cc(OC)c2)CC1	3″,5″-DiMeO-F	fentanyl
+CC(=O)N(c1ccccc1)C1CCN(CCc2ccccc2)CC1	Acetylfentanyl	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CCc2ccc(F)cc2)CC1	4″-Fluorofentanyl	fentanyl
+CCC(=O)N(c1ccccc1)C1(COC(=O)OC)CCN(CCc2cccs2)CC1	Methyl {4-[phenyl(propanoyl)amino]-1-[2-(thiophen-2-yl)ethyl]piperidin-4-yl}methyl carbonate	fentanyl
+CCC(=O)[N+]([O-])(c1ccccc1)C1(C(=O)OC)CCN(CCc2ccccc2)CC1	Carfentanil N-oxide	fentanyl
+CCC(=O)N(c1ccccc1)C1(C(=O)OC)CCN(CCc2cccc(O)c2)CC1	3″-Hydroxycarfentanil	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(C(C)C(=O)OC(C)C)CC1	Propan-2-yl 2-{4-[phenyl(propanoyl)amino]piperidin-1-yl}propanoate	fentanyl
+O=C(C1CCC1)N(c1ccc(Cl)cc1)C1CCN(CCc2ccccc2)CC1	p-Chloro-cyclobutylfentanyl	fentanyl
+CCC(C)C(=O)N(c1ccccc1)C1CCN(CCc2ccccc2)CC1	alpha'-Methyl-butyrylfentanyl	fentanyl
+Oc1cc2c(cc1O)CNCC2	Norsalsolinol	neurotoxin
+CC(N)Cc1ccc(Cl)cc1	PCA	neurotoxin
+CC1NCCc2cc(O)c(O)cc21	Salsolinol	neurotoxin
+CC(N)Cc1ccc(Br)cc1	PBA	neurotoxin
+NCCc1cc(O)c(O)cc1O	6-OHDA	neurotoxin
+COc1ccc(CCN)cc1OC	DMPEA	peyote alkaloid
+CNCCc1cc(OC)c(OC)c(OC)c1	M-M	peyote alkaloid
+COc1cc2c(c(OC)c1OC)C(C)N(C=O)CC2	N-Formyl-O-methylanhalonidine	peyote alkaloid
+COc1cc2c(c3c1OCO3)C(C)[N+](C)(C)CC2	Lophotine	peyote alkaloid
+COc1cc(CCN)ccc1O	GEA	peyote alkaloid
+COc1cc(CCNCC(=O)O)cc(OC)c1OC	Mescaloxylic acid	peyote alkaloid
+COc1cc2c(c(O)c1OC)C(C)N(C=O)CC2	N-Formylanhalonidine	peyote alkaloid
+COc1cc(CCN2C(=O)CC(O)C2=O)cc(OC)c1OC	Mescaline malimide	peyote alkaloid
+CNCCc1ccc(O)c(O)c1	Epinine	peyote alkaloid
+COc1cc2c(c(O)c1OC)C(C)(C(=O)O)NCC2	Peyoruvic acid	peyote alkaloid
+CCN1CCc2cc(OC)c3c(c2C1C)OCO3	Peyophorine	peyote alkaloid
+COc1cc(CCN2C(=O)C=CC2=O)cc(OC)c1OC	Mescaline maleimide	peyote alkaloid
+COc1c(O)cc2c(c1OC)CN(C)CC2	Isoanhalidine	peyote alkaloid
+NCCc1ccc2c(c1)OCO2	MDPEA	peyote alkaloid
+COc1cc2c(c(O)c1OC)C1CCC(=O)N1CC2	Peyoglutam	peyote alkaloid
+COc1cc(CCN)cc(O)c1OC	3-DESMETHYL	peyote alkaloid
+CCOc1ccc(CC(C)N(C)C)c(OCC)c1	2,4-Diethoxy-N,N-dimethylamphetamine	peyote alkaloid
+CN(C)CCc1ccc2c(c1)OCO2	Lobivine	peyote alkaloid
+COc1c(O)cc2c(c1OC)C(C)N(C)CC2	Isopellotine	peyote alkaloid
+COc1cc(CCNC(C)=O)cc(OC)c1OC	N-Acetylmescaline	peyote alkaloid
+COc1cc2c(c3c1OCO3)C(C)N(C(C)=O)CC2	N-Acetylanhalonine	peyote alkaloid
+COc1cc(CCN(C)C)cc(O)c1OC	N,N-Me-3-DESMETHYL	peyote alkaloid
+COc1c(O)cc2c(c1OC)C(C)NCC2	Isoanhalonidine	peyote alkaloid
+COc1cc(CCn2cccc2C(=O)O)cc(OC)c1OC	Peyonine	peyote alkaloid
+COc1cc2c(c(O)c1OC)CN(C(C)=O)CC2	N-Acetylanhalamine	peyote alkaloid
+COc1cc2c(c(O)c1OC)C(C(=O)O)NCC2	Peyoxylic acid	peyote alkaloid
+COc1cc(CCN(C)C)ccc1O	MM-GEA	peyote alkaloid
+COc1cc2c(c(OC)c1OC)CNCC2	Anhalinine	peyote alkaloid
+CNCCc1ccc(O)cc1	HMePEA	peyote alkaloid
+COc1cc2c(c(O)c1OC)C[N+](C)(C)CC2	Anhalotine	peyote alkaloid
+COc1c(O)cc2c(c1OC)CNCC2	Isoanhalamine	peyote alkaloid
+COc1cc(CCN)cc(O)c1O	3,4-DESMETHYL	peyote alkaloid
+COc1cc2c(c(O)c1OC)CN(C=O)CC2	N-Formylanhalamine	peyote alkaloid
+COc1cc(CCNC(C)C(=O)O)cc(OC)c1OC	Mescaloruvic acid	peyote alkaloid
+C[N+](C)(C)CCc1ccc(O)cc1	Candicine	peyote alkaloid
+COc1cc2c(c(O)c1OC)C(C)NCC2	Anhalonidine	peyote alkaloid
+COc1cc2c(c(OC)c1OC)C1CCC(=O)N1CC2	Mescalotam	peyote alkaloid
+COc1cc2c(c3c1OCO3)C(C)NCC2	Anhalonine	peyote alkaloid
+COc1cc2c(c(O)c1OC)C(C)N(C)CC2	Pellotine	peyote alkaloid
+COc1cc2c(c(O)c1OC)CN(C)CC2	Anhalidine	peyote alkaloid
+COc1cc2c(c3c1OCO3)C(C)N(C)CC2	Lophophorine	peyote alkaloid
+COc1cc(CCN)cc2c1OCO2	LOPHOPHINE	peyote alkaloid
+COc1cc(CCNC(C)=O)cc(O)c1OC	N-Acetyl-3-demethymescaline	peyote alkaloid
+COc1cc(CCN)cc(OC)c1OC	M	peyote alkaloid
+COc1cc(CCN2C(=O)CCC2=O)cc(OC)c1OC	Mescaline succinimide	peyote alkaloid
+COc1cc2c(c(O)c1OC)C(C)[N+](C)(C)CC2	Peyotine	peyote alkaloid
+COc1cc2c(c(OC)c1OC)C(C)NCC2	O-Methylanhalonidine	peyote alkaloid
+COc1cc2c(c(O)c1OC)CNCC2	Anhalamine	peyote alkaloid
+COc1cc(CCN2C(=O)CC(O)(CC(=O)O)C2=O)cc(OC)c1OC	Mescaline citrimide	peyote alkaloid
+CN(C)CCc1ccc(O)cc1	Hordenine	peyote alkaloid
+COc1cc(CCNC=O)cc(OC)c1OC	N-Formylmescaline	peyote alkaloid
+CNCCc1cc(O)c(OC)c(OC)c1	N-Me-3-DESMETHYL	peyote alkaloid
+COc1cc(CCn2c(C=O)ccc2CO)cc(OC)c1OC	Peyoglunal	peyote alkaloid
+COc1cc(CCNC=O)cc(O)c1OC	N-Formyl-3-demethylmescaline	peyote alkaloid
+NCCc1ccc(O)c(O)c1	Dopamine	peyote alkaloid
+COc1cc2c(c3c1OCO3)C(C)N(C=O)CC2	N-Formylanhalonine	peyote alkaloid
+CNCCc1ccc(O)c(OC)c1	N-Me-GEA	peyote alkaloid
+COc1cc2c(c(OC)c1OC)CN(C=O)CC2	N-Formylanhalinine	peyote alkaloid
+COc1cc(CCN2C(=O)C3CC(=O)OC3C2=O)cc(OC)c1OC	Mescaline isocitrimide lactone	peyote alkaloid
+COc1cc2c(c(OC)c1OC)C(C)N(C)CC2	O-Methylpellotine	peyote alkaloid
+CCC(C)N(CCc1c[nH]c2ccc(F)cc12)C(C)C	5-Fluoro-IPSBT	tryptamine
+CC(C)N(CCc1c[nH]c2ccc(F)cc12)CC1CC1	5-Fluoro-N-cyclopropylmethyl-NIPT	tryptamine
+CCCCCCN(C)CCc1c[nH]c2ccc(OC)cc12	N-[2-(5-Methoxy-1H-indol-3-yl)ethyl]-N-methylhexan-1-amine	tryptamine
+CN(C)CCc1c[nH]c2c(Br)ccc(O)c12	7-Bromopsilocin	tryptamine
+CCCCN(CCCC)CCc1c[nH]c2cc(OC)c(OC)cc12	5,6-MeO-DBT	tryptamine
+CN(C/C=C/c1ccccc1)CCc1c[nH]c2ccccc12	N-Phenylpropenyl-NMT	tryptamine
+COc1cc2[nH]cc(CCN3CCCC3)c2cc1OC	5,6-MeO-pyr-T	tryptamine
+Cn1cc(CCN)c2c3c(ccc21)OCCC3	CP 132,484	tryptamine
+C=CCN(CCc1c(C)[nH]c2ccc(OC)cc12)C1CCCCC1	2-Methyl-5-methoxy-N-allyl-N-cyclohexyltryptamine	tryptamine
+Cc1cc(OP(=O)(O)O)c2c(CCN)c[nH]c2c1	6-Methyl-4-PO-T	tryptamine
+CCCCCN(CCCCC)CCc1c[nH]c2ccccc12	N,N-Dipentyltryptamine	tryptamine
+COc1ccc2[nH]cc(CC3CCCN3C)c2c1	CP-108509	tryptamine
+COc1ccc(OC)c(CCCN(C)CCc2c[nH]c3ccc(OC)cc23)c1	3-(2,5-Dimethoxyphenyl)-N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-N-methylpropan-1-amine	tryptamine
+C=CCN(CCc1c[nH]c2ccc(F)cc12)C(C)C	5-Fluoro-ALIPT	tryptamine
+NCCc1c[nH]c2ccc(OC3CCCC3)cc12	5-Cyclopentyloxy-T	tryptamine
+COc1ccc(OC)c(CCN(C)CCc2c[nH]c3ccc(OC)cc23)c1	N-(2,5-Dimethoxyphenylethyl)-5-MeO-NMT	tryptamine
+Oc1cccc2[nH]cc(CCN3CCCCC3)c12	4-HO-pip-T	tryptamine
+CN(C)CCc1c[nH]c2cccc(OCc3ccccc3)c12	4-Benzyloxy-DMT	tryptamine
+CN(C)CCc1c[nH]c2cccc(OC(=O)SCc3ccccc3)c12	S-Benzyl O-{3-[2-(dimethylamino)ethyl]-1H-indol-4-yl} carbonothioate	tryptamine
+COc1cc(OC)c2[nH]cc(CCNCc3ccccc3)c2c1	5,7-MeO-T-NB	tryptamine
+CNC(C)Cc1c[nH]c2ccc(OCc3ccccc3)cc12	5-Benzyloxy-alpha-methyl-NMT	tryptamine
+CC(C)(C)CCCCCCCOc1ccc2[nH]cc(CCN)c2c1	5-(8,8-Dimethylnonyloxy)-T	tryptamine
+CCCOc1ccc2[nH]cc(CCN(CC)CC)c2c1	5-PrO-DET	tryptamine
+COc1ccc2[nH]cc(CCN(C)CCCc3cc(OC)c(OC)c(OC)c3)c2c1	N-(3,4,5-Trimethoxyphenylpropyl)-5-MeO-NMT	tryptamine
+c1ccc2c(CCN3CCN(CCc4c[nH]c5ccccc45)CC3)c[nH]c2c1	3,3'-[Piperazine-1,4-diyldi(ethane-2,1-diyl)]di(1H-indole)	tryptamine
+CC(C)N(CCc1c[nH]c2cccc(OCc3ccccc3)c12)C(C)C	4-Benzyloxy-DIPT	tryptamine
+CC(C)N(CCc1c[nH]c2ccc(F)cc12)C1CCC1	5-Fluoro-IPCBT	tryptamine
+CCOc1ccc(CNCCc2c[nH]c3ccccc23)cc1	T-NB4OEt	tryptamine
+O=C(O)CCNCCc1c[nH]c2cc([N+](=O)[O-])ccc12	6-Nitro-N-(2-carboxyethyl)tryptamine	tryptamine
+CN1CCN(CCc2c[nH]c3cccc(O)c23)CC1	4'-Methyl-4-HO-piperazine-T	tryptamine
+CN(CCC#N)CCc1c[nH]c2ccccc12	N-Cyanoethyl-NMT	tryptamine
+COc1cc(F)c2[nH]cc(CCN(C)C)c2c1	7-Fluoro-5-MeO-DMT	tryptamine
+CN(CCc1c[nH]c2ccc(F)cc12)C1CCC1	5-Fluoro-MCBT	tryptamine
+CNCCc1c[nH]c2c(OC)cccc12	7-MeO-NMT	tryptamine
+Cc1c(O)c(O)cc2c(CCN)c[nH]c12	7-Methyl-5,6-HO-T	tryptamine
+Oc1ccc(CNCCc2c[nH]c3ccccc23)cc1	T-NB4OH	tryptamine
+COc1c(Br)cc(Br)cc1CNCCc1c[nH]c2ccccc12	T-NBOMe35Br	tryptamine
+CCn1cc(CCN(C)C)c2c(OCc3ccccc3)cc(F)cc21	1-Ethyl-6-fluoro-4-benzyloxy-DMT	tryptamine
+CN(C)CCc1c[nH]c2cccc(OC(=O)c3cccc(C(=O)Oc4cccc5[nH]cc(CCN(C)C)c45)c3)c12	Bis{3-[2-(dimethylamino)ethyl]-1H-indol-4-yl} benzene-1,3-dicarboxylate	tryptamine
+CCN(CC)C(=O)CCN(C)CCc1c[nH]c2ccc(OC)cc12	N,N-Diethyl-N3-[2-(5-methoxy-1H-indol-3-yl)ethyl]-N3-methyl-beta-alaninamide	tryptamine
+COc1ccc(CNCCc2c[nH]c3c(Br)cc(OC)cc23)cc1	7-Bromo-5-MeO-T-NB4OMe	tryptamine
+CCCN(C)CCc1c[nH]c2ccc(F)cc12	5-Fluoro-MPT	tryptamine
+CN(CCc1c[nH]c2cc3c(cc12)OCO3)Cc1ccccc1	5,6-MDO-NMT-NB	tryptamine
+Cc1c(OC(=O)CCC(=O)O)ccc2[nH]cc(CCN(C)C)c12	Psilocin-4-methyl-5-succinate	tryptamine
+COc1ccc2[nH]cc(CC(C)N)c2c1Br	4-Bromo-5-MeO-AMT	tryptamine
+CN(C)CC(=O)c1c[nH]c2cc(F)ccc12	beta-Oxo-6-fluoro-DMT	tryptamine
+COc1ccc2[nH]cc(C(O)CN(C)C)c2c1	beta-HO-5-MeO-DMT	tryptamine
+COc1cccc2c(CCN)c[nH]c12	7-MeO-T	tryptamine
+COc1cc(I)c2[nH]cc(CCN(C)C)c2c1	7-Iodo-5-MeO-DMT	tryptamine
+C[C@@H]1CC[C@H](C)N1CCc1c[nH]c2ccccc12	(R,S)-Dimethyl-pyr-T	tryptamine
+COc1ccc(Sn2cc(CCN(C)C)c3c(OC)cccc32)cc1	1-(4-Methoxyphenylthio)-4-MeO-DMT	tryptamine
+CCCN(CCc1c[nH]c2c(F)cccc12)C1CCC1	7-Fluoro-PCBT	tryptamine
+CC(=O)NCCc1c[nH]c2cc(F)cc(NC(C)=O)c12	6-Fluoro-4-acetamido-N-acetyltryptamine	tryptamine
+CCCCS(=O)(=O)n1cc(CCN(C)C)c2c(OC)cccc21	1-Butylsulfonyl-4-MeO-DMT	tryptamine
+CCCN(CCC)CCc1c[nH]c2ccc(OC(C)=O)cc12	5-AcO-DPT	tryptamine
+CN(C)CCc1cn(C)c2ccccc12	1-TMT	tryptamine
+CCN(CCc1c[nH]c2cc(F)c(F)cc12)C(C)C	5,6-Difluoro-EIPT	tryptamine
+CN(C)CC(=O)c1c[nH]c2c(F)cc(F)cc12	beta-Oxo-5,7-difluoro-DMT	tryptamine
+CN(C)CCc1cn(C)c2cc(F)cc(OCc3ccccc3)c12	1-Methyl-6-fluoro-4-benzyloxy-DMT	tryptamine
+CCCc1[nH]c2ccc(OC)cc2c1CCN(C)C	2-Propyl-5-MeO-DMT	tryptamine
+CC(=O)Oc1cccc2[nH]cc(CCN(C)C)c12	4-AcO-DMT	tryptamine
+CCC(N)Cc1cc(OC)c(OC)c(OC)c1	C13H21NO3	unknown
+C=CCOc1c(OC)cc(CCN)cc1OC	C13H19NO3	unknown
+COc1cc(SC)c(OC)cc1CC(C)N	C12H19NO2S	unknown
+CCSc1cc(OC)c(CC(C)N)cc1OC	C13H21NO2S	unknown
+COc1cc(SC(C)C)c(OC)cc1CC(C)N	C14H23NO2S	unknown
+COc1cc(Sc2ccccc2)c(OC)cc1CC(C)N	C17H21NO2S	unknown
+CCCSc1cc(OC)c(CC(C)N)cc1OC	C14H23NO2S	unknown
+CCC(N)Cc1cc(OC)c(C)cc1OC	C13H21NO2	unknown
+CCOc1cc(CCN)cc(OC)c1OCC	C13H21NO3	unknown
+CCCCOc1c(OC)cc(CCN)cc1OC	C14H23NO3	unknown
+CNC(C)Cc1cc(OC)c(C)cc1OC	C13H21NO2	unknown
+CSc1cc(CC(C)N)c(SC)cc1C	C12H19NS2	unknown
+COc1cc(C(CN)OC)c(OC)cc1Br	C11H16BrNO3	unknown
+COc1cc(C(CN)OC)c(OC)cc1C	C12H19NO3	unknown
+COC(CN)c1ccc2c(c1)OCO2	C10H13NO3	unknown
+COc1cc(C(O)CN)c(OC)cc1C	C11H17NO3	unknown
+COc1cc(C(CN)OC)cc(OC)c1OC	C12H19NO4	unknown
+COc1cc(CC(C)N)cc(OC)c1Br	C11H16BrNO2	unknown
+CC(N)Cc1cc2c(cc1Br)OCO2	C10H12BrNO2	unknown
+COc1cc(CCN)c(OC)cc1Br	C10H14BrNO2	unknown
+COc1cc(CC(C)N)cc(OC)c1OCc1ccccc1	C18H23NO3	unknown
+COc1cc(CCN)c(OC)cc1Cl	C10H14ClNO2	unknown
+COc1cc(CCN)c(OC)cc1C	C11H17NO2	unknown
+CCc1cc(OC)c(CCN)cc1OC	C12H19NO2	unknown
+CCOc1c(OC)cc(CC(C)N)cc1OC	C13H21NO3	unknown
+COc1cc(CCN)c(OC)cc1F	C10H14FNO2	unknown
+COc1cc(CCN)c(OC)c(C)c1C	C12H19NO2	unknown
+COc1cc(CCN)c(OC)c2c1CCC2	C13H19NO2	unknown
+COc1cc(CCN)c(OC)c2c1CCCC2	C14H21NO2	unknown
+COc1cc(CCN)c(OC)c2c1C1CCC2C1	C15H21NO2	unknown
+COc1cc(CCN)c(OC)c2ccccc12	C14H17NO2	unknown
+COc1ccc(OC)c(CCN)c1	C10H15NO2	unknown
+COc1cc(CCN)c(OC)cc1I	C10H14INO2	unknown
+COc1cc([N+](=O)[O-])c(OC)cc1CCN	C10H14N2O4	unknown
+COc1cc(OC(C)C)c(OC)cc1CCN	C13H21NO3	unknown
+CCCc1cc(OC)c(CCN)cc1OC	C13H21NO2	unknown
+COc1cc(CCN)cc(OC)c1OCC1CC1	C14H21NO3	unknown
+COc1cc([Se]C)c(OC)cc1CCN	C11H17NO2Se	unknown
+COc1cc(SC)c(OC)cc1CCN	C11H17NO2S	unknown
+CCSc1cc(OC)c(CCN)cc1OC	C12H19NO2S	unknown
+COc1cc(SC(C)C)c(OC)cc1CCN	C13H21NO2S	unknown
+COc1cc(SC(C)C)cc(OC)c1CCN	C13H21NO2S	unknown
+CCCSc1cc(OC)c(CCN)cc1OC	C13H21NO2S	unknown
+COc1cc(SCC2CC2)c(OC)cc1CCN	C14H21NO2S	unknown
+COc1cc(SC(C)(C)C)c(OC)cc1CCN	C14H23NO2S	unknown
+COCCSc1cc(OC)c(CCN)cc1OC	C13H21NO3S	unknown
+COc1cc(SC2CC2)c(OC)cc1CCN	C13H19NO2S	unknown
+CCC(C)Sc1cc(OC)c(CCN)cc1OC	C14H23NO2S	unknown
+COc1cc(SCCF)c(OC)cc1CCN	C12H18FNO2S	unknown
+[2H]C([2H])([2H])Oc1c(OC)cc(CCN)cc1OC	C11H17NO3	unknown
+[2H]C([2H])(CN)c1cc(OC)c(OC)c(OC)c1	C11H17NO3	unknown
+COc1cc(CCN)cc(OC)c1C	C11H17NO2	unknown
+COc1ccc(CC(C)N)c(OC)c1	C11H17NO2	unknown
+COc1ccc(OC)c(CC(C)N)c1	C11H17NO2	unknown
+COc1ccc(CC(C)N)cc1OC	C11H17NO2	unknown
+COc1cc(C2CC2N)c(OC)cc1C	C12H17NO2	unknown
+COc1ccc(C(O)CN)cc1OC	C10H15NO3	unknown
+COc1cc(CC(C)N)c(OC)c2c1OCO2	C12H17NO4	unknown
+COc1c(CC(C)N)cc2c(c1OC)OCO2	C12H17NO4	unknown
+CCCCCc1cc(OC)c(CC(C)N)cc1OC	C16H27NO2	unknown
+COc1cc(CC(C)N)c(OC)cc1Br	C11H16BrNO2	unknown
+CCCCc1cc(OC)c(CC(C)N)cc1OC	C15H25NO2	unknown
+COc1cc(CC(C)N)c(OC)cc1Cl	C11H16ClNO2	unknown
+COc1cc(CC(C)N)c(OC)cc1CCF	C13H20FNO2	unknown
+CCc1cc(OC)c(CC(C)N)cc1OC	C13H21NO2	unknown
+COc1cc(CC(C)N)c(OC)cc1I	C11H16INO2	unknown
+COc1cc(CC(C)N)c(OC)cc1C	C12H19NO2	unknown
+COc1cc(C)cc(OC)c1CC(C)N	C12H19NO2	unknown
+COc1cc([N+](=O)[O-])c(OC)cc1CC(C)N	C11H16N2O4	unknown
+CCCc1cc(OC)c(CC(C)N)cc1OC	C14H23NO2	unknown
+CCOc1c(OC)cc(CCN)cc1OC	C12H19NO3	unknown
+CCOc1cc(OCC)c(OCC)cc1CC(C)N	C15H25NO3	unknown
+CCOc1cc(OCC)c(OC)cc1CC(C)N	C14H23NO3	unknown
+CCOc1cc(OC)c(OCC)cc1CC(C)N	C14H23NO3	unknown
+CCOc1cc(OC)c(OC)cc1CC(C)N	C13H21NO3	unknown
+CCNC(CC)Cc1ccc2c(c1)OCO2	C13H19NO2	unknown
+CCCC(Cc1ccc2c(c1)OCO2)NCC	C14H21NO2	unknown
+COc1cc2c(cc1CC(C)N)OC(C)C2	C13H19NO2	unknown
+COc1cc2c(cc1CC(C)N)OC(C)(C)C2	C14H21NO2	unknown
+CC(Cc1ccc2c(c1)OCO2)N(C)O	C11H15NO3	unknown
+COc1cc(CC(C)N)c(OC)c2c1CCC2	C14H21NO2	unknown
+COc1cc(CC(C)N)c(OC)c2c1CCCC2	C15H23NO2	unknown
+COc1cc(CC(C)N)c(OC)c2c1C1CCC2C1	C16H23NO2	unknown
+COc1cc(CC(C)N)c(OC)c(C)c1C	C13H21NO2	unknown
+COc1cc(CC(C)N)c(OC)c2ccccc12	C15H19NO2	unknown
+CCSc1cc(OC)c(CCNO)cc1OC	C12H19NO3S	unknown
+CCCSc1cc(OC)c(CCNO)cc1OC	C13H21NO3S	unknown
+CCC(C)Sc1cc(OC)c(CCNO)cc1OC	C14H23NO3S	unknown
+COc1cc(CC(C)N(C)C)c(OC)cc1I	C13H20INO2	unknown
+COc1ccc(CCN)c(OC)c1OC	C11H17NO3	unknown
+COc1cc(CCN)cc(OC)c1OC(C)C	C13H21NO3	unknown
+CCOc1cc(CC(C)N)c(OC)cc1C	C13H21NO2	unknown
+CCC(N)Cc1ccc2c(c1)OCO2	C11H15NO2	unknown
+COc1ccc(CC(C)N)cc1	C10H15NO	unknown
+CNC(C)Cc1cc2c(cc1C)OCO2	C12H17NO2	unknown
+C=C(C)COc1c(OC)cc(CCN)cc1OC	C14H21NO3	unknown
+CC(N)Cc1ccc2c(c1)OCO2	C10H13NO2	unknown
+C=CCNC(C)Cc1ccc2c(c1)OCO2	C13H17NO2	unknown
+CCCCNC(C)Cc1ccc2c(c1)OCO2	C14H21NO2	unknown
+CC(Cc1ccc2c(c1)OCO2)NCc1ccccc1	C17H19NO2	unknown
+CC(Cc1ccc2c(c1)OCO2)NCC1CC1	C14H19NO2	unknown
+CC(Cc1ccc2c(c1)OCO2)N(C)C	C12H17NO2	unknown
+CCNC(C)Cc1ccc2c(c1)OCO2	C12H17NO2	unknown
+CC(Cc1ccc2c(c1)OCO2)NCCO	C12H17NO3	unknown
+CC(C)NC(C)Cc1ccc2c(c1)OCO2	C13H19NO2	unknown
+CNC(C)Cc1ccc2c(c1)OCO2	C11H15NO2	unknown
+CNC(C)Cc1ccc2c(c1)OCCO2	C12H17NO2	unknown
+CONC(C)Cc1ccc2c(c1)OCO2	C11H15NO3	unknown
+COCCNC(C)Cc1ccc2c(c1)OCO2	C13H19NO3	unknown
+CNC(C)(C)Cc1ccc2c(c1)OCO2	C12H17NO2	unknown
+CC(Cc1ccc2c(c1)OCO2)NO	C10H13NO3	unknown
+CC(C)(N)Cc1ccc2c(c1)OCO2	C11H15NO2	unknown
+C#CCNC(C)Cc1ccc2c(c1)OCO2	C13H15NO2	unknown
+CCCNC(C)Cc1ccc2c(c1)OCO2	C13H19NO2	unknown
+CCOc1cc(CCN)cc(OC)c1OC	C12H19NO3	unknown
+COc1cc(CC(C)N)cc2c1OCCO2	C12H17NO3	unknown
+CCOc1cc(CC(C)N)c(OC)cc1OCC	C14H23NO3	unknown
+CCOc1cc(OC)c(CC(C)N)cc1OC	C13H21NO3	unknown
+CCOc1ccc(CCN)cc1OC	C11H17NO2	unknown
+COc1cc(OC)c(CC(C)N)cc1Br	C11H16BrNO2	unknown
+COc1cc(OC)c(SC)cc1CC(C)N	C12H19NO2S	unknown
+CNC(C)Cc1cc(OC)ccc1OC	C12H19NO2	unknown
+CNC(C)Cc1cc(OC)c(Br)cc1OC	C12H18BrNO2	unknown
+CCC(Cc1ccc2c(c1)OCO2)NC	C12H17NO2	unknown
+CCCC(Cc1ccc2c(c1)OCO2)NC	C13H19NO2	unknown
+CNC(C)Cc1ccc(OC)cc1	C11H17NO	unknown
+CNC(C)Cc1cc2c(cc1OC)OCO2	C12H17NO3	unknown
+COc1cc(CC(C)N)cc2c1OCO2	C11H15NO3	unknown
+COc1cc2c(cc1CC(C)N)OCO2	C11H15NO3	unknown
+COc1c(CC(C)N)ccc2c1OCO2	C11H15NO3	unknown
+COc1ccc(CC(C)N)c2c1OCO2	C11H15NO3	unknown
+CCOc1cc(CC(C)N)c(OC)cc1OC	C13H21NO3	unknown
+CCCOc1cc(CCN)cc(OC)c1OC	C13H21NO3	unknown
+CCCOc1cc(OC)c(CC(C)N)cc1OC	C14H23NO3	unknown
+COc1cc(CC(C)N)c(SC)cc1OC	C12H19NO2S	unknown
+CCCOc1c(OC)cc(CCN)cc1OC	C13H21NO3	unknown
+COc1cc(CCN)cc(OC)c1OCCc1ccccc1	C18H23NO3	unknown
+NCCc1ccccc1	C8H11N	unknown
+C#CCOc1c(OC)cc(CCN)cc1OC	C13H17NO3	unknown
+CCOc1cc(CCN)cc(OCC)c1OC	C13H21NO3	unknown
+COc1cc(CC(C)N)c(OC)c(OC)c1OC	C13H21NO4	unknown
+CCOc1c(OC)cc(CCN)cc1SCC	C13H21NO2S	unknown
+CCOc1cc(CCN)cc(OC)c1SCC	C13H21NO2S	unknown
+CCOc1cc(CCN)cc(SC)c1OCC	C13H21NO2S	unknown
+CCCCSc1c(OC)cc(CCN)cc1OC	C14H23NO2S	unknown
+CCOc1c(OC)cc(CCN)cc1SC	C12H19NO2S	unknown
+CCSc1c(OC)cc(CCN)cc1OC	C12H19NO2S	unknown
+COc1ccc(CCN)c(SC)c1OC	C11H17NO2S	unknown
+COc1ccc(CCN)c(OC)c1SC	C11H17NO2S	unknown
+COc1c(CCN)ccc(SC)c1OC	C11H17NO2S	unknown
+COc1cc(CCN)cc(SC)c1OC	C11H17NO2S	unknown
+COc1cc(CCN)cc(OC)c1SC	C11H17NO2S	unknown
+COc1cc(CC(C)N)cc(OC)c1OC	C12H19NO3	unknown
+COc1cc(OC)c(OC)cc1CC(C)N	C12H19NO3	unknown
+COc1ccc(CC(C)N)c(OC)c1OC	C12H19NO3	unknown
+COc1cc(CC(C)N)c(OC)c(OC)c1	C12H19NO3	unknown
+COc1ccc(OC)c(OC)c1CC(C)N	C12H19NO3	unknown
+COc1cc(OC)c(CC(C)N)c(OC)c1	C12H19NO3	unknown
+CCSc1cc(CCN)cc(OC)c1OC	C12H19NO2S	unknown
+CCOc1cc(CCN)cc(OC)c1SC	C12H19NO2S	unknown
+CCOc1cc(CCN)cc(SC)c1OC	C12H19NO2S	unknown
+CSc1c(CC(C)N)ccc2c1OCO2	C11H15NO2S	unknown
+COc1cc2c(cc1CC(C)N)OCS2	C11H15NO2S	unknown
+COc1cc(OC)c(OC)cc1CCN	C11H17NO3	unknown
+CCc1cc(SC)c(CC(C)N)cc1OC	C13H21NOS	unknown
+CCc1cc(OC)c(CC(C)N)cc1SC	C13H21NOS	unknown
+COc1cc(CC(C)N)c(SC)cc1C	C12H19NOS	unknown
+COc1cc(C)c(SC)cc1CC(C)N	C12H19NOS	unknown
+COc1cc(C)c(S(C)=O)cc1CC(C)N	C12H19NO2S	unknown
+CCCSc1c(OC)cc(CCN)cc1OC	C13H21NO2S	unknown
+CCOc1cc(CCN)cc(OCC)c1OCC	C14H23NO3	unknown
+CCOc1cc(CCN)cc(SCC)c1OC	C13H21NO2S	unknown
+CCOc1cc(CCN)cc(OCC)c1SC	C13H21NO2S	unknown
+CCOc1cc(CCN)cc(SCC)c1OCC	C14H23NO2S	unknown
+CCOc1cc(CCN)cc(OCC)c1SCC	C14H23NO2S	unknown
+CCCC(N)Cc1cc(OC)c(OC)c(OC)c1	C14H23NO3	unknown
+CCCCC(N)Cc1cc(OC)c(OC)c(OC)c1	C15H25NO3	unknown
+CCCCCC(N)Cc1cc(OC)c(OC)c(OC)c1	C16H27NO3	unknown
+CCC(N)Cc1cc(OC)ccc1OC	C12H19NO2	unknown
+CCC(N)Cc1ccc(OC)c(OC)c1	C12H19NO2	unknown
+CCC(N)Cc1cc(OC)c(Br)cc1OC	C12H18BrNO2	unknown
+CCC(Cc1ccc(OC)cc1OC)N(C)C	C14H23NO2	unknown
+CCC(Cc1cc(OC)ccc1OC)N(C)C	C14H23NO2	unknown
+CCC(Cc1cc(OC)cc(OC)c1)N(C)C	C14H23NO2	unknown
+CCC(Cc1cc(OC)c(C)cc1OC)NO	C13H21NO3	unknown
+CCC(N)Cc1c(OC)cc(OC)cc1OC	C13H21NO3	unknown
+COc1cc(C)c(OC)c(C)c1CC(C)N	C13H21NO2	unknown
+COc1cc(CC(C)NC2CC2)c(OC)cc1C	C15H23NO2	unknown
+CCOC(CN)c1cc(OC)c(C)cc1OC	C13H21NO3	unknown
+CCOc1cc(Br)c(OC)cc1CCN	C11H16BrNO2	unknown
+CCOc1cc(CCN)c(OCC)cc1Br	C12H18BrNO2	unknown
+COc1cc(Br)c(CCN)cc1OC	C10H14BrNO2	unknown
+CNCCc1cc(OC)c(OC)cc1Br	C11H16BrNO2	unknown
+COc1cc(CC(C)N)cc(OC)c1OCc1ccc(F)cc1	C18H22FNO3	unknown
+COc1cc(CCN)c(OC)cc1C#N	C11H14N2O2	prophetic
+COc1cc(C(=O)O)c(OC)cc1CCN	C11H15NO4	unknown
+CNCCc1cc(OC)c(C)cc1OC	C12H19NO2	unknown
+COc1cc(CCN(C)C)c(OC)cc1C	C13H21NO2	unknown
+CCOc1cc(C)c(OC)cc1CCN	C12H19NO2	unknown
+CCOc1cc(CCN)c(OC)cc1C	C12H19NO2	unknown
+CCOc1cc(CCN)c(OCC)cc1C	C13H21NO2	unknown
+CCOc1cc(CCN)c(OC)cc1CC	C13H21NO2	unknown
+COc1cc(CC(C)N)c(OC)cc1F	C11H16FNO2	unknown
+CCOc1cc(I)c(OC)cc1CCN	C11H16INO2	unknown
+CCOc1cc(SC)c(OC)cc1CCN	C12H19NO2S	unknown
+CCOc1cc(CCN)c(OC)cc1SC	C12H19NO2S	unknown
+CCOc1cc(SCC)c(OC)cc1CCN	C13H21NO2S	unknown
+CCOc1cc(CCN)c(OC)cc1SCC	C13H21NO2S	unknown
+CCOc1cc(SCC)c(OCC)cc1CCN	C14H23NO2S	unknown
+CCOc1cc(SC(C)C)c(OC)cc1CCN	C14H23NO2S	unknown
+CCCSc1cc(OCC)c(CCN)cc1OC	C14H23NO2S	unknown
+Cc1ccc(C)c(CC(C)N)c1	C11H17N	unknown
+Cc1ccc(CC(C)N)cc1C	C11H17N	unknown
+Cc1ccccc1CC(C)N	C10H15N	unknown
+Cc1cccc(CC(C)N)c1	C10H15N	unknown
+Cc1ccc(CC(C)N)cc1	C10H15N	unknown
+COc1ccc(OC)c(CC(C)N(C)C)c1	C13H21NO2	unknown
+COc1cc(CC(C)N(C)C)c(OC)cc1F	C13H20FNO2	unknown
+Cc1ccc(C)c(CC(C)N(C)C)c1	C13H21N	unknown
+Cc1cc(CC(C)N(C)C)c(C)cc1F	C13H20FN	unknown
+COc1cccc(OC)c1CC(C)N(C)C	C13H21NO2	unknown
+COc1cc(CC(C)N(C)C)cc(OC)c1	C13H21NO2	unknown
+COc1cc(C2CC2N)cc(OC)c1OC	C12H17NO3	unknown
+NCC(O)c1ccc2c(c1)OCO2	C9H11NO3	unknown
+COc1cc([C@@H](C)[C@H](C)N)c(OC)c2c1OCO2	C13H19NO4	unknown
+COc1cc([C@H](C)[C@H](C)N)c(OC)c2c1OCO2	C13H19NO4	unknown
+COc1ccc(CCNC(C)=O)cc1OC	C12H17NO3	unknown
+COc1ccc(CC(=O)O)cc1OC	C10H12O4	unknown
+COc1cc(CC(C)N)c(OC)cc1CC(C)C	C15H25NO2	unknown
+COc1cc(C(C)(C)C)c(OC)cc1CC(C)N	C15H25NO2	unknown
+CCC(C)c1cc(OC)c(CC(C)N)cc1OC	C15H25NO2	unknown
+COc1cc(CC(C)N)c(OC)cc1N	C11H18N2O2	unknown
+COc1cc(NC(C)=O)c(OC)cc1CC(C)N	C13H20N2O3	unknown
+CCC(N)Cc1cc(OC)c(I)cc1OC	C12H18INO2	unknown
+COc1cc(OC)c(CC(C)N)cc1C	C12H19NO2	unknown
+COc1cc(C)c(CC(C)N)cc1OC	C12H19NO2	unknown
+COc1cc(C)c(CC(C)N)c(OC)c1	C12H19NO2	unknown
+COc1cc(C)c(OC)c(OC)c1CC(C)N	C13H21NO3	unknown
+CCC(O)c1cc(OC)c(CC(C)N)cc1OC	C14H23NO3	unknown
+COc1cc(C(C)C)c(OC)cc1CC(C)N	C14H23NO2	unknown
+COc1cc2c(cc1CC(C)N)OCC2	C12H17NO2	unknown
+COc1cc(CC(C)NCc2ccccc2)c(OC)cc1I	C18H22INO2	unknown
+COc1cc(CC(C)N(C)Cc2ccccc2)c(OC)cc1I	C19H24INO2	unknown
+COc1cc(CC(C)NCC#N)c(OC)cc1I	C13H17IN2O2	unknown
+COc1cc(CC(C)NCC2CC2)c(OC)cc1I	C15H22INO2	unknown
+CCN(CC)C(C)Cc1cc(OC)ccc1OC	C15H25NO2	unknown
+CCN(CC)C(C)Cc1cc(OC)c(I)cc1OC	C15H24INO2	unknown
+COc1cc(CC(C)NCCCN(C)C)c(OC)cc1I	C16H27IN2O2	unknown
+CCCCCCCCCCCCNC(C)Cc1cc(OC)c(I)cc1OC	C23H40INO2	unknown
+CCCCCCNC(C)Cc1cc(OC)c(I)cc1OC	C17H28INO2	unknown
+CNC(C)Cc1cc(OC)c(I)cc1OC	C12H18INO2	unknown
+COc1cc(CC(C)N(C)C(C)C)c(OC)cc1I	C15H24INO2	unknown
+COc1cc(CC(C)NC(C)C)c(OC)cc1I	C14H22INO2	unknown
+COc1cc(CCN(C)C)cc(OC)c1OC	C13H21NO3	unknown
+COc1cc(CC(=O)O)cc(OC)c1OC	C11H14O5	unknown
+COc1cc(OCCN)cc(OC)c1OC	C11H17NO4	unknown
+COc1cc(OCCN(C)C)cc(OC)c1OC	C13H21NO4	unknown
+COc1ccccc1CC(C)N	C10H15NO	unknown
+COc1cccc(CC(C)N)c1	C10H15NO	unknown
+CNC(C)Cc1ccccc1OC	C11H17NO	unknown
+CCC(N)c1ccc2c(c1)OCO2	C10H13NO2	unknown
+CCC(NC)c1ccc2c(c1)OCO2	C11H15NO2	unknown
+NCCCc1ccc2c(c1)OCO2	C10H13NO2	unknown
+CC(N)Cc1ccc2c(c1)OC(C)O2	C11H15NO2	unknown
+CC(N)Cc1ccc2c(c1)OC(C)(C)O2	C12H17NO2	unknown
+CC(N)Cc1cccc2c1OCO2	C10H13NO2	unknown
+CC(C)CNC(C)Cc1ccc2c(c1)OCO2	C14H21NO2	unknown
+CC(Cc1ccc2c(c1)OCO2)NC(C)(C)C	C14H21NO2	unknown
+CCCCCNC(C)Cc1ccc2c(c1)OCO2	C15H23NO2	unknown
+CCCCCCNC(C)Cc1ccc2c(c1)OCO2	C16H25NO2	unknown
+CCCCCCCCNC(C)Cc1ccc2c(c1)OCO2	C18H29NO2	unknown
+CCN(CC)C(C)Cc1ccc2c(c1)OCO2	C14H21NO2	unknown
+CC(Cc1ccc2c(c1)OCO2)NCC#N	C12H14N2O2	unknown
+CC(Cc1ccc2c(c1)OCO2)NNC(C)(C)C	C14H22N2O2	unknown
+CC(Cc1ccc2c(c1)OCO2)NCC(F)(F)F	C12H14F3NO2	unknown
+CNCCc1ccc2c(c1)OCO2	C10H13NO2	unknown
+COc1cc(CC(C)N)cc2c1OCCCO2	C13H19NO3	unknown
+COc1cc(Br)c(CC(C)N)cc1OC	C11H16BrNO2	unknown
+CNC(C)Cc1cc(OC)c(OC)c(OC)c1	C13H21NO3	unknown
+CNC(C)Cc1cc(OC)c(OC)cc1OC	C13H21NO3	unknown
+CNC(C)Cc1c(OC)cc(OC)cc1OC	C13H21NO3	unknown
+CCCC(N)Cc1ccc2c(c1)OCO2	C12H17NO2	unknown
+CCCCC(N)Cc1ccc2c(c1)OCO2	C13H19NO2	unknown
+CCCCC(Cc1ccc2c(c1)OCO2)NC	C14H21NO2	unknown
+CCCCC(Cc1ccc2c(c1)OCO2)NCC	C15H23NO2	unknown
+COc1ccc(CC(C)N(C)C)cc1	C12H19NO	unknown
+COc1ccccc1CC(C)N(C)C	C12H19NO	unknown
+CNC(C)Cc1cc(OC)c2c(c1OC)OCO2	C13H19NO4	unknown
+COc1cc2c(cc1CCN)OCO2	C10H13NO3	unknown
+CCC(N)Cc1cc2c(cc1OC)OCO2	C12H17NO3	unknown
+CCOc1cc2c(cc1CC(C)N)OCO2	C12H17NO3	unknown
+COc1ccc2c(c1CC(C)N)OCO2	C11H15NO3	unknown
+COc1cc(OC(C)C)c(OC)cc1CC(C)N	C14H23NO3	unknown
+CCCCOc1cc(OC)c(CC(C)N)cc1OC	C15H25NO3	unknown
+CCCCCOc1cc(OC)c(CC(C)N)cc1OC	C16H27NO3	unknown
+COc1ccc(CCN)cc1	C9H13NO	unknown
+NCCc1ccc(Cl)cc1	C8H10ClN	unknown
+COc1ccc(OC)c(OC)c1CCN	C11H17NO3	unknown
+COc1cc(OC)c(CCN)c(OC)c1	C11H17NO3	unknown
+CCc1cc(OC)c(CCN)cc1SC	C12H19NOS	unknown
+COc1cc(CCN)c(SC)cc1C	C11H17NOS	unknown
+COc1cc(C)c(SC)cc1CCN	C11H17NOS	unknown
+COc1cc2c(cc1CC(C)N)OC(C)C2C	C14H21NO2	unknown
+COc1cc2c(cc1CC(C)N)OC(C)C2(C)C	C15H23NO2	unknown
+COc1cc(CC(C)N)c2c(c1)CC(C)O2	C13H19NO2	unknown
+COc1cc(CC(C)N)c2c(c1)CC(C)(C)O2	C14H21NO2	unknown
+CCC1Cc2cc(OC)c(CC(C)N)cc2O1	C14H21NO2	unknown
+COc1cc2c(cc1CC(C)N)OCCC2	C13H19NO2	unknown
+COc1cc(CCN)cc(OC)c1OCc1ccccc1	C17H21NO3	unknown
+CCCCCOc1c(OC)cc(CCN)cc1OC	C15H25NO3	unknown
+CCCCCCOc1c(OC)cc(CCN)cc1OC	C16H27NO3	unknown
+CCCCCCCOc1c(OC)cc(CCN)cc1OC	C17H29NO3	unknown
+CCCCCCc1cc(OC)c(CC(C)N)cc1OC	C17H29NO2	unknown
+COc1cc(CC(C)N)c(OC)cc1Cc1ccccc1	C18H23NO2	unknown
+COc1cc(CC2CC2)c(OC)cc1CC(C)N	C15H23NO2	unknown
+CCc1cc(SC)c(CCN)cc1OC	C12H19NOS	unknown
+COc1cc(CC(C)N)cc2c1OC(C)O2	C12H17NO3	unknown
+CN[C@@H](C)[C@H](O)c1ccccc1	C10H15NO	unknown
+CN[C@@H](C)[C@@H](O)c1ccccc1	C10H15NO	unknown
+CNC(C)Cc1ccccc1	C10H15N	unknown
+CNC(C)C(=O)c1ccccc1	C10H13NO	beta-ketone
+CC(N)C(=O)c1ccccc1	C9H11NO	beta-ketone
+C[C@@H]([C@H](O)c1ccccc1)N(C)C	C11H17NO	unknown
+CC(N)Cc1ccccc1	C9H13N	unknown
+CC(Cc1ccccc1)N(C)C	C11H17N	unknown
+CC(N)Cc1ccc(F)cc1	C9H12FN	unknown
+CSc1ccc(CC(C)N)cc1	C10H15NS	unknown
+CNC[C@H](O)c1ccc(O)c(O)c1	C9H13NO3	unknown
+NC[C@H](O)c1ccc(O)c(O)c1	C8H11NO3	unknown
+NCCc1ccc(O)cc1	C8H11NO	peyote-alkaloid
+NCC(O)c1ccc(O)cc1	C8H11NO2	unknown
+CSc1cc(CCN)c(SC)cc1C	C11H17NS2	unknown
+N[C@@H](Cc1ccc(O)cc1)C(=O)O	C9H11NO3	unknown
+CNC(C)C(=O)c1ccc(C)cc1	C11H15NO	beta-ketone
+CCNC(C)C(=O)c1ccccc1	C11H15NO	beta-ketone
+NCCc1c2c(cc3c1OCC3)OCC2	C12H15NO2	unknown
+NCCc1c2c(c(Br)c3c1OCC3)OCC2	C12H14BrNO2	unknown
+CC(N)Cc1c2c(cc3c1OCC3)OCC2	C13H17NO2	unknown
+CC(N)Cc1c2c(c(Br)c3c1OCC3)OCC2	C13H16BrNO2	unknown
+Cc1c2c(c(CC(C)N)c3c1OCC3)OCC2	C14H19NO2	unknown
+CC(N)Cc1c2c(c(C(F)(F)F)c3c1OCC3)OCC2	C14H16F3NO2	unknown
+COc1ccccc1CNCCc1c2c(c(Br)c3c1OCC3)OCC2	C20H22BrNO3	unknown
+Cc1c2c(c(CCN)c3c1OCC3)OCC2	C13H17NO2	unknown
+Cc1c2c(c(CCN)c3c1OCO3)CCO2	C12H15NO3	unknown
+Cc1c2c(c(CC(C)N)c3c1OCO3)CCO2	C13H17NO3	unknown
+NCCc1c2ccoc2c(Br)c2ccoc12	C12H10BrNO2	unknown
+CC(N)Cc1c2ccoc2c(Br)c2ccoc12	C13H12BrNO2	unknown
+COc1cc(C(F)(F)F)c(OC)cc1CCN	C11H14F3NO2	unknown
+CNC(C)C(=O)c1ccc2c(c1)OCO2	C11H13NO3	beta-ketone
+CCC(NC)C(=O)c1ccc2c(c1)OCO2	C12H15NO3	beta-ketone
+CC(N)Cc1ccc2c(c1)CCC2	C12H17N	unknown
+CCCOc1c(OC)cc(CC(C)N)cc1OC	C14H23NO3	unknown
+COc1cc(CC(C)N)cc(OC)c1	C11H17NO2	unknown
+COc1cc(CC(C)(C)N)c(OC)cc1C	C13H21NO2	unknown
+COc1cc([C@H](C)[C@@H](C)N)c(OC)cc1C	C13H21NO2	unknown
+COc1cc([C@@H](C)[C@@H](C)N)c(OC)cc1C	C13H21NO2	unknown
+CCOc1cc(C)c(OC)cc1CC(C)N	C13H21NO2	unknown
+COc1cc(CC(C)N)cc(OC)c1OC(C)C	C14H23NO3	unknown
+CCCCOc1c(OC)cc(CC(C)N)cc1OC	C15H25NO3	unknown
+CCCCCOc1c(OC)cc(CC(C)N)cc1OC	C16H27NO3	unknown
+CCCCCCCOc1c(OC)cc(CC(C)N)cc1OC	C18H31NO3	unknown
+CCCCCCOc1c(OC)cc(CC(C)N)cc1OC	C17H29NO3	unknown
+COc1cc(O)c(C(O)CN)cc1OC	C10H15NO4	unknown
+C=CCOc1c(OC)cc(CC(C)N)cc1OC	C14H21NO3	unknown
+CCCCCCC(N)Cc1cc(OC)c(OC)c(OC)c1	C17H29NO3	unknown
+CCCCCCCC(N)Cc1cc(OC)c(OC)c(OC)c1	C18H31NO3	unknown
+CCCCCCCCCC(N)Cc1cc(OC)c(OC)c(OC)c1	C20H35NO3	unknown
+COc1ccc(CC(C)N(C)C)c2c1CCC2	C15H23NO	unknown
+COc1ccc(CC(C)N)c2c1CCC2	C13H19NO	unknown
+COc1cc(CCN)c(OC)c2c1CC2	C12H17NO2	unknown
+COc1cc(CC(C)N)c(OC)c2c1CC2	C13H19NO2	unknown
+COc1ccc(OC)c(C(O)C(C)NC(C)(C)C)c1	C15H25NO3	unknown
+COc1cc(C(CN)OC(C)=O)c(OC)cc1C	C13H19NO4	unknown
+COc1cc(CCN)c(OC)c2c1C1CCC2CC1	C16H23NO2	unknown
+CCOc1cc(OC)c(CCN)cc1OC	C12H19NO3	unknown
+CCCOc1cc(OC)c(CCN)cc1OC	C13H21NO3	unknown
+CCCCOc1cc(OC)c(CCN)cc1OC	C14H23NO3	unknown
+COc1cc(CC(C)N)cc(OC)c1OCC1CC1	C15H23NO3	unknown
+CC[Se]c1cc(OC)c(CCN)cc1OC	C12H19NO2Se	unknown
+COc1cc([Se]C(C)C)c(OC)cc1CCN	C13H21NO2Se	unknown
+CCC[Se]c1cc(OC)c(CCN)cc1OC	C13H21NO2Se	unknown
+COc1cc([Se]CCF)c(OC)cc1CCN	C12H18FNO2Se	unknown
+COc1cc([Te]C)c(OC)cc1CCN	C11H17NO2Te	unknown
+CCCSc1cc(OC)c(CCNC)cc1OC	C14H23NO2S	unknown
+COc1cc(SCC2CC2)c(OC)cc1CC(C)N	C15H23NO2S	unknown
+COc1cc(Sc2ccccn2)c(OC)cc1CCN	C15H18N2O2S	unknown
+COc1cc(Sc2ccc(Br)cc2)c(OC)cc1CCN	C16H18BrNO2S	unknown
+COc1cc(SN2CCOCC2)c(OC)cc1CCN	C14H22N2O3S	unknown
+COc1cc(SCCSC)c(OC)cc1CCN	C13H21NO2S2	unknown
+COc1cc(SC2CCCCC2)c(OC)cc1CCN	C16H25NO2S	unknown
+COc1cc(SC2CCCCC2)c(OC)cc1CC(C)N	C17H27NO2S	unknown
+C=CCSc1cc(OC)c(CC(C)N)cc1OC	C14H21NO2S	unknown
+C=CCSc1cc(OC)c(CCN)cc1OC	C13H19NO2S	prophetic
+COc1cc(Sc2ccccc2)c(OC)cc1CCN	C16H19NO2S	unknown
+COc1cc(SCCF)c(OC)cc1CC(C)N	C13H20FNO2S	unknown
+CCCCSc1cc(OC)c(CCN)cc1OC	C14H23NO2S	unknown
+COc1cc(SCC(F)F)c(OC)cc1CCN	C12H17F2NO2S	prophetic
+COc1cc(SCC(F)(F)F)c(OC)cc1CCN	C12H16F3NO2S	unknown
+[2H]C([2H])([2H])Oc1cc(CCN)cc(OC([2H])([2H])[2H])c1OC	C11H17NO3	unknown
+[2H]c1c(CCN)c([2H])c(OC)c(OC)c1OC	C11H17NO3	unknown
+[2H]C([2H])(N)Cc1cc(OC)c(OC)c(OC)c1	C11H17NO3	unknown
+COc1c(C)cc(CCN)cc1C	C11H17NO	unknown
+Cc1cc(CCN)cc(C)c1C	C11H17N	unknown
+Cc1cc(CC(C)N)cc(C)c1C	C12H19N	unknown
+COc1ccc(CC(C)N(C)C)c(OC)c1	C13H21NO2	unknown
+COc1cc(OC)c(CC(C)N(C)C)cc1I	C13H20INO2	unknown
+COc1cc(OC)c(CC(C)N(C)C)cc1F	C13H20FNO2	unknown
+CCOc1cc(OC)ccc1CC(C)N(C)C	C14H23NO2	unknown
+CCCCOc1cc(OC)ccc1CC(C)N(C)C	C16H27NO2	unknown
+CCCCCCCCCCOc1cc(OC)ccc1CC(C)N(C)C	C22H39NO2	unknown
+CC(C)Oc1ccc(CC(C)N(C)C)c(OC(C)C)c1	C17H29NO2	unknown
+COc1cc(OC)c(OC)cc1CC(C)=O	C12H16O4	unknown
+COc1cccc(CCN)c1	C9H13NO	unknown
+COc1cc(SC2CCC2)c(OC)cc1CCN	C14H21NO2S	unknown
+COc1cc(SC2CCCC2)c(OC)cc1CCN	C15H23NO2S	unknown
+CC(C(=O)c1ccccc1)N(C)C	C11H15NO	beta-ketone
+CNC(C)C(=O)c1ccc(OC)cc1	C11H15NO2	beta-ketone
+CNC(C)C(=O)c1ccc(F)cc1	C10H12FNO	beta-ketone
+CNC(C)C(=O)c1cccc(F)c1	C10H12FNO	beta-ketone
+CC(C(=O)c1ccccc1)N1CCCC1	C13H17NO	beta-ketone
+Cc1ccc(C(=O)C(C)N2CCCC2)cc1	C14H19NO	beta-ketone
+COc1ccc(C(=O)C(C)N2CCCC2)cc1	C14H19NO2	beta-ketone
+CCCC(C(=O)c1ccc(C)cc1)N1CCCC1	C16H23NO	beta-ketone
+CCC(C(=O)c1ccc(C)cc1)N1CCCC1	C15H21NO	beta-ketone
+CCCCC(C(=O)c1ccc(C)cc1)N1CCCC1	C17H25NO	beta-ketone
+Cc1ccc(C(=O)C(C)(C)N2CCCC2)cc1	C15H21NO	beta-ketone
+CCCC(Cc1ccccc1)N1CCCC1	C15H23N	unknown
+CC(N)C(=O)c1ccc2c(c1)OCO2	C10H11NO3	beta-ketone
+CCN(CC)C(C)C(=O)c1ccc2c(c1)OCO2	C14H19NO3	beta-ketone
+CC(C(=O)c1ccc2c(c1)OCO2)N(C)C	C12H15NO3	beta-ketone
+CC(C(=O)c1ccc2c(c1)OCO2)N1CCCC1	C14H17NO3	beta-ketone
+CNC(C)C(=O)c1ccccc1F	C10H12FNO	beta-ketone
+CNC(C)Cc1cccc(OC)c1	C11H17NO	unknown
+CCNC(C)Cc1ccc(OC)cc1	C12H19NO	unknown
+CC(N)Cc1ccccc1F	C9H12FN	unknown
+CC(N)Cc1cccc(F)c1	C9H12FN	unknown
+CNC(C)Cc1ccccc1F	C10H14FN	unknown
+CNC(C)Cc1cccc(F)c1	C10H14FN	unknown
+CNC(C)Cc1ccc(F)cc1	C10H14FN	unknown
+COc1ccc(F)cc1CC(C)N	C10H14FNO	unknown
+COc1ccc(CC(C)N)cc1F	C10H14FNO	unknown
+CCNC(C)Cc1ccc(F)cc1	C11H16FN	unknown
+CCC(N)Cc1ccc(F)cc1	C10H14FN	unknown
+CCOc1ccc(CC(C)N)cc1	C11H17NO	unknown
+COc1cc(CCN)c2c(c1)OCO2	C10H13NO3	unknown
+CNC(C)Cc1ccc(Cl)cc1	C10H14ClN	unknown
+CCC(N)Cc1ccc(Cl)cc1	C10H14ClN	unknown
+CCCC(C(=O)c1ccc2c(c1)OCO2)N1CCCC1	C16H21NO3	beta-ketone
+Cc1c(CC(C)N)ccc2c1OCO2	C11H15NO2	unknown
+Cc1cc(CC(C)N)cc2c1OCO2	C11H15NO2	unknown
+Cc1cc2c(cc1CC(C)N)OCO2	C11H15NO2	unknown
+CNC(C)Cc1ccc2c(c1C)OCO2	C12H17NO2	unknown
+CC(N)Cc1ccc(O)cc1	C9H13NO	unknown
+NC1Cc2cc3c(cc2C1)OCO3	C10H11NO2	unknown
+COc1cc2c(cc1C)CC(N)C2	C11H15NO	unknown
+CNC1Cc2cc3c(cc2C1)OCO3	C11H13NO2	unknown
+COc1cc(CC(C)N)ccc1C	C11H17NO	unknown
+COc1cc(CC(C)N)c2c(c1)OCO2	C11H15NO3	unknown
+CNC(C)Cc1ccc(OC)cc1OC	C12H19NO2	unknown
+CCNC(C)Cc1ccc(OC)cc1OC	C13H21NO2	unknown
+CCCNC(C)Cc1ccc(OC)cc1OC	C14H23NO2	unknown
+COc1ccc(CC(C)NC(C)C)c(OC)c1	C14H23NO2	unknown
+CCCCCCNC(C)Cc1ccc(OC)cc1OC	C17H29NO2	unknown
+CCN(CC)C(C)Cc1ccc(OC)cc1OC	C15H25NO2	unknown
+COc1ccc(I)c(OC)c1CC(C)N(C)C	C13H20INO2	unknown
+COc1cc(CC(C)N(C)C)c(I)c(OC)c1	C13H20INO2	unknown
+COc1cccc(CC(C)N)c1OC	C11H17NO2	unknown
+COc1cccc(OC)c1CC(C)N	C11H17NO2	unknown
+COc1ccc(Br)c(OC)c1CC(C)N(C)C	C13H20BrNO2	unknown
+COc1cc(CC(C)N(C)C)c(F)c(OC)c1	C13H20FNO2	unknown
+COc1c(I)cc(CC(C)N(C)C)c2c1CCC2	C15H22INO	unknown
+C=CCN1C[C@H](C(=O)N(CC)CC)C=C2c3cccc4[nH]cc(c34)C[C@H]21	C22H27N3O	unknown
+CCCCN(CCCC)CCc1c[nH]c2ccccc12	C18H28N2	tryptamine
+CCN(CC)CCc1c[nH]c2ccccc12	C14H20N2	tryptamine
+CC(C)N(CCc1c[nH]c2ccccc12)C(C)C	C16H24N2	tryptamine
+COc1ccc2[nH]cc(CC(C)N)c2c1	C12H16N2O	tryptamine
+CN(C)CCc1c[nH]c2ccccc12	C12H16N2	tryptamine
+Cc1[nH]c2ccccc2c1CC(C)N	C12H16N2	tryptamine
+CNC(C)Cc1c[nH]c2ccccc12	C12H16N2	tryptamine
+CCCN(CCC)CCc1c[nH]c2ccccc12	C16H24N2	tryptamine
+CCN(CCc1c[nH]c2ccccc12)C(C)C	C15H22N2	tryptamine
+CCC(N)Cc1c[nH]c2ccccc12	C12H16N2	tryptamine
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(CC)C1	C21H27N3O	unknown
+COc1ccc2c3c([nH]c2c1)C(C)=NCC3	C13H14N2O	unknown
+COc1ccc2c(c1)[nH]c1c(C)nccc12	C13H12N2O	unknown
+CCCCN(CCCC)CCc1c[nH]c2cccc(O)c12	C18H28N2O	tryptamine
+CCN(CC)CCc1c[nH]c2cccc(O)c12	C14H20N2O	tryptamine
+CC(C)N(CCc1c[nH]c2cccc(O)c12)C(C)C	C16H24N2O	tryptamine
+CN(C)CCc1c[nH]c2cccc(O)c12	C12H16N2O	tryptamine
+CN(C)CCc1c[nH]c2ccc(O)cc12	C12H16N2O	tryptamine
+CCCN(CCC)CCc1c[nH]c2cccc(O)c12	C16H24N2O	tryptamine
+CCN(C)CCc1c[nH]c2cccc(O)c12	C13H18N2O	tryptamine
+CC(C)N(C)CCc1c[nH]c2cccc(O)c12	C14H20N2O	tryptamine
+CCCN(C)CCc1c[nH]c2cccc(O)c12	C14H20N2O	tryptamine
+Oc1cccc2[nH]cc(CCN3CCCC3)c12	C14H18N2O	tryptamine
+CC[C@H]1C[C@@H]2C[C@H]3c4[nH]c5ccc(OC)cc5c4CCN(C2)[C@@H]13	C20H26N2O	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C20H25N3O	unknown
+CCCCN(C)CCc1c[nH]c2ccccc12	C15H22N2	tryptamine
+CC(C)N(CCc1c[nH]c2ccc3c(c12)OCO3)C(C)C	C17H24N2O2	tryptamine
+CC(C)N(CCc1c[nH]c2cc3c(cc12)OCO3)C(C)C	C17H24N2O2	tryptamine
+CN(C)CCc1c[nH]c2ccc3c(c12)OCO3	C13H16N2O2	tryptamine
+CN(C)CCc1c[nH]c2cc3c(cc12)OCO3	C13H16N2O2	tryptamine
+CC(C)N(C)CCc1c[nH]c2cc3c(cc12)OCO3	C15H20N2O2	tryptamine
+CCN(CC)CCc1c(C)[nH]c2ccccc12	C15H22N2	tryptamine
+Cc1[nH]c2ccccc2c1CCN(C)C	C13H18N2	tryptamine
+COc1ccc2[nH]cc(CCNC(C)=O)c2c1	C13H16N2O2	tryptamine
+CCN(CC)CCc1c[nH]c2ccc(OC)cc12	C15H22N2O	tryptamine
+COc1ccc2[nH]cc(CCN(C(C)C)C(C)C)c2c1	C17H26N2O	tryptamine
+COc1ccc2[nH]cc(CCN(C)C)c2c1	C13H18N2O	tryptamine
+COc1cccc2[nH]cc(CCN(C)C(C)C)c12	C15H22N2O	tryptamine
+COc1ccc2[nH]cc(CCN(C)C(C)C)c2c1	C15H22N2O	tryptamine
+COc1cc2[nH]cc(CCN(C)C(C)C)c2cc1OC	C16H24N2O2	tryptamine
+CNCCc1c[nH]c2ccc(OC)cc12	C12H16N2O	tryptamine
+COc1ccc2[nH]cc(CCN3CCCC3)c2c1	C15H20N2O	tryptamine
+COc1ccc2[nH]c3c(c2c1)CCNC3C	C13H16N2O	unknown
+COc1ccc2[nH]c(C)c(CCN(C)C)c2c1	C14H20N2O	tryptamine
+CSc1ccc2[nH]cc(CCN(C)C)c2c1	C13H18N2S	tryptamine
+CC(C)N(C)CCc1c[nH]c2ccccc12	C14H20N2	tryptamine
+CC(N)Cc1c[nH]c2ccccc12	C11H14N2	tryptamine
+CCNCCc1c[nH]c2ccccc12	C12H16N2	tryptamine
+CNCCc1c[nH]c2ccccc12	C11H14N2	tryptamine
+CCCN1C[C@H](C(=O)N(CC)CC)C=C2c3cccc4[nH]cc(c34)C[C@H]21	C22H29N3O	unknown
+c1ccc2c(CCN3CCCC3)c[nH]c2c1	C14H18N2	tryptamine
+NCCc1c[nH]c2ccccc12	C10H12N2	tryptamine
+COc1ccc2c3c([nH]c2c1)C(C)NCC3	C13H16N2O	unknown
+CNC(C)Cc1c[nH]c2ccc(OC)cc12	C13H18N2O	tryptamine
+CC(C)NCCc1c[nH]c2ccccc12	C13H18N2	tryptamine
+CCN(CC)CCc1c[nH]c2cccc(OP(=O)(O)O)c12	C14H21N2O4P	tryptamine
+CN(C)CCc1c[nH]c2cccc(OP(=O)(O)O)c12	C12H17N2O4P	tryptamine
+CCCN(CCC)CCc1c[nH]c2ccc(OC)cc12	C17H26N2O	tryptamine
+CCN(CC)CCc1c[nH]c2cc(O)ccc12	C14H20N2O	tryptamine
+CCN(CC)CCc1c[nH]c2cc(F)ccc12	C14H19FN2	tryptamine
+CN(C)CCc1c[nH]c2cc(O)ccc12	C12H16N2O	tryptamine
+CCC(C)N(CCc1c[nH]c2cccc(O)c12)C(C)CC	C18H28N2O	tryptamine
+CC(N)Cc1c[nH]c2ccc(F)cc12	C11H13FN2	tryptamine
+CC(N)Cc1c[nH]c2cc(F)ccc12	C11H13FN2	tryptamine
+CN(O)CCc1c[nH]c2ccccc12	C11H14N2O	tryptamine
+CNCCc1c(O)[nH]c2ccccc12	C11H14N2O	tryptamine
+c1ccc2c(CCNC3CC3)c[nH]c2c1	C13H16N2	tryptamine
+COc1ccc2[nH]cc(CCNC3CC3)c2c1	C14H18N2O	tryptamine
+COc1cccc2c(CCNC3CC3)c[nH]c12	C14H18N2O	tryptamine
+COn1cc(CCN(C)C)c2ccccc21	C13H18N2O	tryptamine
+CN(C)CCc1c[nH]c2ccc(Br)cc12	C12H15BrN2	tryptamine
+CN(C)CCc1c[nH]c2cc(Br)c(Br)cc12	C12H14Br2N2	tryptamine
+NCCc1c[nH]c2cc(Br)c(Br)cc12	C10H10Br2N2	tryptamine
+CC(Cc1c[nH]c2ccccc12)N(C)C	C13H18N2	tryptamine
+CCNC(C)Cc1c[nH]c2ccccc12	C13H18N2	tryptamine
+CC(C)NC(C)Cc1c[nH]c2ccccc12	C14H20N2	tryptamine
+CCCN(CCC)CCc1cn(CCC)c2ccccc12	C19H30N2	tryptamine
+CCN(CC)CCc1cn(CC)c2ccccc12	C16H24N2	tryptamine
+CCCN(CCc1c[nH]c2ccccc12)C(C)C	C16H24N2	tryptamine
+CCCCN(CCc1c[nH]c2ccccc12)C(C)C	C17H26N2	tryptamine
+CNCCc1c[nH]c2cccc(OP(=O)(O)O)c12	C11H15N2O4P	tryptamine
+NCCc1c[nH]c2cccc(OP(=O)(O)O)c12	C10H13N2O4P	tryptamine
+CNCCc1c[nH]c2cccc(O)c12	C11H14N2O	tryptamine
+NCCc1c[nH]c2cccc(O)c12	C10H12N2O	tryptamine
+CN(C)CCc1cn(C)c2cccc(O)c12	C13H18N2O	tryptamine
+NCCc1c[nH]c2ccc(O)cc12	C10H12N2O	tryptamine
+CN(C)CCc1c[nH]c2ccc(OS(=O)(=O)O)cc12	C12H16N2O4S	tryptamine
+CCOc1ccc2[nH]cc(CCN(C)C)c2c1	C14H20N2O	tryptamine
+CNCCc1c[nH]c2ccc(O)cc12	C11H14N2O	tryptamine
+CC(=O)Oc1ccc2[nH]cc(CCN(C)C)c2c1	C14H18N2O2	tryptamine
+CCCCN(C)CCc1c[nH]c2cccc(O)c12	C15H22N2O	tryptamine
+CC(C)CN(C)CCc1c[nH]c2cccc(O)c12	C15H22N2O	tryptamine
+CCC(C)N(C)CCc1c[nH]c2cccc(O)c12	C15H22N2O	tryptamine
+CN(CCc1c[nH]c2cccc(O)c12)C(C)(C)C	C15H22N2O	tryptamine
+Oc1cccc2[nH]cc(CCN3CCOCC3)c12	C14H18N2O2	tryptamine
+CCCC(N)Cc1c[nH]c2ccccc12	C13H18N2	tryptamine
+CCC(N)Cc1c[nH]c2ccc(OC)cc12	C13H18N2O	tryptamine
+COc1ccc2[nH]cc(CCN)c2c1OCc1ccccc1	C18H20N2O2	tryptamine
+CCN(C)CCc1c[nH]c2ccc(OC)c(O)c12	C14H20N2O2	tryptamine
+COc1ccc2[nH]cc(CCN)c2c1	C11H14N2O	tryptamine
+CCCCCC(=O)NCCc1c[nH]c2ccc(OC)cc12	C17H24N2O2	tryptamine
+CCCCCCCC(=O)NCCc1c[nH]c2ccc(OC)cc12	C19H28N2O2	tryptamine
+COc1ccc2[nH]cc(CCNC(=O)C(F)(F)C(F)(F)C(F)(F)F)c2c1	C15H13F7N2O2	tryptamine
+COc1ccc2[nH]c(I)c(CCNC(C)=O)c2c1	C13H15IN2O2	tryptamine
+N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O	C11H12N2O2	tryptamine
+N[C@@H](Cc1c[nH]c2ccc(O)cc12)C(=O)O	C11H12N2O3	tryptamine
+CC(C)(C)N(CCc1c[nH]c2cccc(O)c12)C(C)(C)C	C18H28N2O	tryptamine
+COc1cc2c(CCN)c[nH]c2cc1O	C11H14N2O2	tryptamine
+COc1cc2c(CCN(C)C)c[nH]c2cc1O	C13H18N2O2	tryptamine
+COc1cccc2[nH]cc(CCN(C)C)c12	C13H18N2O	tryptamine
+COc1ccc2c(CCN(C)C)c[nH]c2c1	C13H18N2O	tryptamine
+COc1cccc2c(CCN(C)C)c[nH]c12	C13H18N2O	tryptamine
+CCN(CC)CCc1c[nH]c2cccc(OC)c12	C15H22N2O	tryptamine
+COc1ccc2c(CCN(C)C(C)C)c[nH]c2c1	C15H22N2O	tryptamine
+COc1cccc2c(CCN(C)C(C)C)c[nH]c12	C15H22N2O	tryptamine
+COc1cccc2c(CCNC(C)C)c[nH]c12	C14H20N2O	tryptamine
+CC(C)CN(CCc1c[nH]c2cccc(O)c12)CC(C)C	C18H28N2O	tryptamine
+COc1cc2[nH]cc(CCN(C)C)c2cc1OC	C14H20N2O2	tryptamine
+CCN(CC)CCc1c[nH]c2cc(OC)c(OC)cc12	C16H24N2O2	tryptamine
+COc1cc2[nH]cc(CCN3CCOCC3)c2cc1OC	C16H22N2O3	tryptamine
+COc1cc2[nH]cc(CCN3CCCCC3)c2cc1OC	C17H24N2O2	tryptamine
+COc1cc2c(CCN(C)C)c[nH]c2cc1C	C14H20N2O	tryptamine
+COc1ccc2[nH]cc(CCN3CCOCC3)c2c1	C15H20N2O2	tryptamine
+COc1ccc2[nH]cc(CCN3CCCCC3)c2c1	C16H22N2O	tryptamine
+CSc1cccc2[nH]cc(CCN(C)C)c12	C13H18N2S	tryptamine
+CSc1cccc2[nH]cc(CCN(C(C)C)C(C)C)c12	C17H26N2S	tryptamine
+COc1cccc2[nH]cc(CCN(C(C)C)C(C)C)c12	C17H26N2O	tryptamine
+CCN(C)CCc1c[nH]c2ccccc12	C13H18N2	tryptamine
+CCCN(C)CCc1c[nH]c2ccccc12	C14H20N2	tryptamine
+CC(N)Cc1c[nH]c2cccc(O)c12	C11H14N2O	tryptamine
+CC(N)Cc1c[nH]c2ccc(O)cc12	C11H14N2O	tryptamine
+CC(N)Cc1cn(C)c2ccccc12	C12H16N2	tryptamine
+CC(C)(N)Cc1c[nH]c2ccccc12	C12H16N2	tryptamine
+Cc1cccc2[nH]cc(CC(C)N)c12	C12H16N2	tryptamine
+C[C@](N)(Cc1c[nH]c2ccccc12)C(=O)O	C12H14N2O2	tryptamine
+CCCNCCc1c[nH]c2ccccc12	C13H18N2	tryptamine
+CCCCNCCc1c[nH]c2ccccc12	C14H20N2	tryptamine
+CC(C)CNCCc1c[nH]c2ccccc12	C14H20N2	tryptamine
+CCC(C)NCCc1c[nH]c2ccccc12	C14H20N2	tryptamine
+CC(C)(C)NCCc1c[nH]c2ccccc12	C14H20N2	tryptamine
+CCCCCNCCc1c[nH]c2ccccc12	C15H22N2	tryptamine
+CCCCCCNCCc1c[nH]c2ccccc12	C16H24N2	tryptamine
+c1ccc2c(CCN3CCCCC3)c[nH]c2c1	C15H20N2	tryptamine
+c1ccc2c(CCN3CCOCC3)c[nH]c2c1	C14H18N2O	tryptamine
+COc1ccc2[nH]cc(CC(C)N(C)C)c2c1	C14H20N2O	unknown
+C[N+](C)(C)CCc1c[nH]c2ccc([O-])cc12	C13H18N2O	tryptamine
+C[N+]1(C)CCc2c[nH]c3ccc([O-])c1c23	C12H14N2O	unknown
+C[N+]1(C)CCc2c[nH]c3ccc(OS(=O)O)c1c23	C12H14N2O3S	unknown
+COc1ccc2[nH]cc3c2c1N(C)CC3	C12H14N2O	unknown
+C[C@]12CC[C@H](O)C[C@H]1CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](c3ccc(=O)oc3)[C@@H](O)C[C@]12O	C24H34O5	unknown
+CC(=O)O[C@H]1C[C@]2(O)[C@@H]3CC[C@@H]4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]2(C)[C@H]1c1ccc(=O)oc1	C26H36O6	unknown
+C[C@]12CC[C@H]3[C@@H](CC[C@]4(O)C[C@@H](O)CC[C@]34C=O)[C@]13O[C@@H]3C[C@@H]2c1ccc(=O)oc1	C24H30O6	unknown
+CC(=O)O[C@H]1C[C@]2(O)[C@@H]3CC[C@@H]4C[C@@H](OC(=O)CCCCCCC(=O)N[C@@H](CCCN=C(N)N)C(=O)O)CC[C@]4(C)[C@H]3CC[C@]2(C)[C@H]1c1ccc(=O)oc1	C40H60N4O10	unknown
+CNCCc1c[nH]c2cc(Br)c(Br)cc12	C11H12Br2N2	tryptamine
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(C)=O)C[C@H]2N(C)C1	C22H27N3O2	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C)C[C@H]2N(C)C1	C21H27N3O	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4CO)C[C@H]2N(C)C1	C21H27N3O2	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4CN(C)C)C[C@H]2N(C)C1	C23H32N4O	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4[nH]c(Br)c(c34)C[C@H]2N(C)C1	C20H24BrN3O	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4[nH]c(I)c(c34)C[C@H]2N(C)C1	C20H24IN3O	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(c(Br)n4C)C[C@H]2N(C)C1	C21H26BrN3O	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(c(I)n4C)C[C@H]2N(C)C1	C21H26IN3O	unknown
+CN1C[C@H](C(N)=O)C=C2c3cccc4[nH]cc(c34)C[C@H]21	C16H17N3O	unknown
+CNC(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C17H19N3O	unknown
+CCNC(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C18H21N3O	unknown
+CCCNC(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C19H23N3O	unknown
+C[C@@H](CO)NC(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C19H23N3O2	unknown
+CCCCNC(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C20H25N3O	unknown
+CCC(C)NC(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C20H25N3O	unknown
+CCC(CO)NC(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C20H25N3O2	unknown
+CCCCCNC(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C21H27N3O	unknown
+CCCC(C)NC(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C21H27N3O	unknown
+CCC(CC)NC(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C21H27N3O	unknown
+CCCCCCNC(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C22H29N3O	unknown
+CCCCC(C)NC(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C22H29N3O	unknown
+CCCCCCCNC(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C23H31N3O	unknown
+CCCCCC(C)NC(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C23H31N3O	unknown
+CN(C)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C18H21N3O	unknown
+CCN(C)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C19H23N3O	unknown
+CCCN(C)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C20H25N3O	unknown
+CC(C)N(C)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C20H25N3O	unknown
+CC(Cc1ccccc1)N(C)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C26H29N3O	unknown
+CCCN(CC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C21H27N3O	unknown
+CCCN(CCC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C22H29N3O	unknown
+CC(C)N(C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1)C(C)C	C22H29N3O	unknown
+C=CCN(CC=C)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C22H25N3O	unknown
+CCCCN(CCCC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C24H33N3O	unknown
+CN1C[C@H](C(=O)N2CCCC2)C=C2c3cccc4[nH]cc(c34)C[C@H]21	C20H23N3O	unknown
+CN1C[C@H](C(=O)N2CC=CC2)C=C2c3cccc4[nH]cc(c34)C[C@H]21	C20H21N3O	unknown
+CN1C[C@H](C(=O)N2CCCCC2)C=C2c3cccc4[nH]cc(c34)C[C@H]21	C21H25N3O	unknown
+CN1C[C@H](C(=O)N2CCOCC2)C=C2c3cccc4[nH]cc(c34)C[C@H]21	C20H23N3O2	unknown
+CCNC(=O)[C@@H]1C=C2c3cccc4c3c(cn4C)C[C@H]2N(C)C1	C19H23N3O	unknown
+CCC(CO)NC(=O)[C@@H]1C=C2c3cccc4c3c(cn4C)C[C@H]2N(C)C1	C21H27N3O2	unknown
+CCNC(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(C)=O)C[C@H]2N(C)C1	C20H23N3O2	unknown
+CN1C[C@H](C(=O)N2CCCC2)C=C2c3cccc4c3c(cn4C)C[C@H]21	C21H25N3O	unknown
+C#CCN1C[C@H](C(=O)N(CC)CC)C=C2c3cccc4[nH]cc(c34)C[C@H]21	C22H25N3O	unknown
+CCCCN1C[C@H](C(=O)N(CC)CC)C=C2c3cccc4[nH]cc(c34)C[C@H]21	C23H31N3O	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(CCc2ccccc2)C1	C27H31N3O	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2NC1	C19H23N3O	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(CC[18F])C1	C21H26FN3O	unknown
+CCN(CC)C(=O)[C@H]1C=C2c3cccc4[nH]cc(c34)C[C@@H]2N(C)C1	C20H25N3O	unknown
+CCN(CC)C(=O)[C@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C20H25N3O	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@@H]2N(C)C1	C20H25N3O	unknown
+CN1C[C@H](CO)C=C2c3cccc4[nH]cc(c34)C[C@H]21	C16H18N2O	unknown
+CN[C@@H]1Cc2c[nH]c3cccc(c23)[C@H]1/C=C(\C)CO	C16H20N2O	unknown
+CN1C[C@](O)(CO)C=C2c3cccc4[nH]cc(c34)C[C@H]21	C16H18N2O2	unknown
+CN1CC(CO)=C[C@@H]2c3cccc4[nH]cc(c34)C[C@H]21	C16H18N2O	unknown
+CC1=C[C@@H]2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C16H18N2	unknown
+CN1C[C@@](C)(O)C=C2c3cccc4[nH]cc(c34)C[C@H]21	C16H18N2O	unknown
+C[C@@H]1C[C@@H]2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C16H20N2	unknown
+CN1C[C@@]2(C)C[C@]23c2cccc4[nH]cc(c24)C[C@@H]13	C16H18N2	unknown
+C=C1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C16H16N2	unknown
+CN1C[C@H](C(=O)O)C=C2c3cccc4[nH]cc(c34)C[C@H]21	C16H16N2O2	unknown
+CN1C[C@@H](C(N)=O)C=C2c3cccc4[nH]cc(c34)C[C@H]21	C16H17N3O	unknown
+CCN(CC)C(=O)[C@H]1CN(C)[C@@H]2Cc3c[nH]c4cccc(c34)C2(O)C1	C20H27N3O2	unknown
+C[C@H]1C[C@H](C)N1C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C21H25N3O	unknown
+CC(O)NC(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C18H21N3O2	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C2CC2)C1	C22H27N3O	unknown
+NCCc1c[nH]c2c(O)cc(O)cc12	C10H12N2O2	tryptamine
+CC(=O)NCCc1c[nH]c2ccc(O)cc12	C12H14N2O2	tryptamine
+CCN(CC)CCc1c[nH]c2cccc(OC(C)=O)c12	C16H22N2O2	tryptamine
+CC(=O)Oc1cccc2[nH]cc(CCN(C(C)C)C(C)C)c12	C18H26N2O2	tryptamine
+C=CCN(CC=C)CCc1c[nH]c2ccc(OC)cc12	C17H22N2O	tryptamine
+C=CCN(CC=C)CCc1c[nH]c2ccccc12	C16H20N2	tryptamine
+C[N+](C)(C)CCc1c[nH]c2cccc(OP(=O)(O)O)c12	C13H19N2O4P	tryptamine
+Cc1ccc2[nH]cc(CCN(C)C)c2c1	C13H18N2	tryptamine
+COc1ccc2[nH]cc(CCN(C)C)c2c1O	C13H18N2O2	prophetic,tryptamine
+CN1CCCC1Cc1c[nH]c2cccc(O)c12	C14H18N2O	tryptamine
+C#Cc1cc(OC)c(CCN)cc1OC	C12H15NO2	prophetic
+COc1cc(CCNCc2ccccc2O)c(OC)cc1I	C17H20INO3	unknown
+COc1cc(CCNCc2ccccc2OC)c(OC)cc1I	C18H22INO3	unknown
+COc1cc(C(F)(F)F)c(OC)cc1CC(C)N	C12H16F3NO2	unknown
+CNC(C)Cc1cc(OC)c2c(c1)OCO2	C12H17NO3	unknown
+COc1ccc(C(O)CN(C)C)cc1OC	C12H19NO3	unknown
+COc1cc(Br)c(OC)c2c1C(CN)C2	C11H14BrNO2	unknown
+COc1ccc(OC)c(CCNCc2ccccc2O)c1	C17H21NO3	unknown
+COc1ccc(OC)c(CCNCc2ccccc2OC)c1	C18H23NO3	unknown
+COc1cc(CC(C)NCc2ccccc2OC)c(OC)cc1I	C19H24INO3	unknown
+COc1ccc(OC)c(CCNCc2ccccc2)c1	C17H21NO2	unknown
+COc1ccccc1CNCC1Cc2c(OC)c(Br)cc(OC)c21	C19H22BrNO3	unknown
+CNCCc1cc(OC)ccc1OC	C11H17NO2	unknown
+CCCNCCc1cc(OC)ccc1OC	C13H21NO2	unknown
+COc1ccc(CCN)c(OC)c1	C10H15NO2	unknown
+COc1ccc(CCNCc2ccccc2)c(OC)c1	C17H21NO2	unknown
+COc1cc(CCNCc2ccc3ccccc3c2)c(OC)cc1I	C21H22INO2	unknown
+COc1cc(CCNCc2cccc3c2OCO3)c(OC)cc1I	C18H20INO4	unknown
+COc1cc(C(C)O)c(OC)cc1CCN	C12H19NO3	unknown
+COc1cc(C(C)=O)c(OC)cc1CCN	C12H17NO3	unknown
+Cn1cc(CCN)c2cc(O)ccc21	C11H14N2O	tryptamine
+COc1ccc2c3cc[n+](C)c(C)c3n(C)c2c1	C15H17N2O	unknown
+Cc1nccc2c1[nH]c1ccccc12	C12H10N2	unknown
+CC1=NCCc2c1[nH]c1ccccc21	C12H12N2	unknown
+CC1NCCc2c1[nH]c1ccccc21	C12H14N2	unknown
+Cc1nccc2c1[nH]c1ccc(O)cc12	C12H10N2O	unknown
+CC1=NCCc2c1[nH]c1ccc(O)cc21	C12H12N2O	unknown
+CC1NCCc2c1[nH]c1ccc(O)cc21	C12H14N2O	unknown
+COc1ccc2[nH]c3c(C)nccc3c2c1	C13H12N2O	unknown
+COc1ccc2[nH]c3c(c2c1)CCN=C3C	C13H14N2O	unknown
+Cc1nccc2c1[nH]c1cc(O)ccc12	C12H10N2O	unknown
+CC1=NCCc2c1[nH]c1cc(O)ccc21	C12H12N2O	unknown
+CC1NCCc2c1[nH]c1cc(O)ccc21	C12H14N2O	unknown
+c1ccc2c(c1)[nH]c1cnccc12	C11H8N2	unknown
+C1=NCCc2c1[nH]c1ccccc21	C11H10N2	unknown
+c1ccc2c3c([nH]c2c1)CNCC3	C11H12N2	unknown
+Oc1ccc2[nH]c3cnccc3c2c1	C11H8N2O	unknown
+Oc1ccc2[nH]c3c(c2c1)CCN=C3	C11H10N2O	unknown
+Oc1ccc2[nH]c3c(c2c1)CCNC3	C11H12N2O	unknown
+COc1ccc2[nH]c3cnccc3c2c1	C12H10N2O	unknown
+COc1ccc2[nH]c3c(c2c1)CCN=C3	C12H12N2O	unknown
+COc1ccc2[nH]c3c(c2c1)CCNC3	C12H14N2O	unknown
+Oc1ccc2c(c1)[nH]c1cnccc12	C11H8N2O	unknown
+Oc1ccc2c3c([nH]c2c1)C=NCC3	C11H10N2O	unknown
+Oc1ccc2c3c([nH]c2c1)CNCC3	C11H12N2O	unknown
+COc1ccc2c(c1)[nH]c1cnccc12	C12H10N2O	unknown
+COc1ccc2c3c([nH]c2c1)C=NCC3	C12H12N2O	unknown
+COc1ccc2c3c([nH]c2c1)CNCC3	C12H14N2O	unknown
+CC1NC(C(=O)O)Cc2c1[nH]c1ccccc21	C13H14N2O2	unknown
+CCOC(=O)c1cc2c(cn1)[nH]c1ccccc12	C14H12N2O2	unknown
+O=C(O)c1cc2c(cn1)[nH]c1ccccc12	C12H8N2O2	unknown
+O=C(O)C1Cc2c([nH]c3ccccc23)CN1	C12H12N2O2	unknown
+CN1CCc2c([nH]c3ccccc23)C1	C12H14N2	unknown
+CCOC(=O)C1(c2ccccc2)CCN(C)CC1	C15H21NO2	unknown
+CCC(=O)OC1(c2ccccc2)CCN(C)CC1	C15H21NO2	unknown
+CN1CC=C(c2ccccc2)CC1	C12H15N	unknown
+C[n+]1ccc(-c2ccccc2)cc1	C12H12N	unknown
+COc1ccc2c(c1)c(CCN)cn2C(C)C	C14H20N2O	tryptamine
+COc1ccc2c(c1)c(CCN(C)C)cn2C(C)C	C16H24N2O	tryptamine
+COc1cc(C)ccc1CC(C)N	C11H17NO	unknown
+COc1cc(CC(C)NCc2cccc3c2OCO3)c(OC)cc1I	C19H22INO4	unknown
+COc1ccc2[nH]cc(CCNCc3ccccc3OC)c2c1	C19H22N2O2	tryptamine
+COc1cc(CCNCc2ccco2)c(OC)cc1I	C15H18INO3	unknown
+COc1cc(CCNCc2cccs2)c(OC)cc1I	C15H18INO2S	unknown
+COc1cc(CCNCc2ccccn2)c(OC)cc1I	C16H19IN2O2	unknown
+COc1cc(CCNCc2ccccc2C#N)c(OC)cc1I	C18H19IN2O2	unknown
+COc1cc(CCNCc2ccccc2C(N)=O)c(OC)cc1I	C18H21IN2O3	unknown
+COc1cc(CCNCc2c[nH]c3ccccc23)c(OC)cc1I	C19H21IN2O2	unknown
+COc1cc(CCNCc2cccc3ccccc23)c(OC)cc1I	C21H22INO2	unknown
+COc1cc(CCNCc2ccccc2CO)c(OC)cc1I	C18H22INO3	unknown
+COc1cc(CCNCC2CCCO2)c(OC)cc1I	C15H22INO3	unknown
+COc1cc(CCNCc2cc3ccccc3cc2O)c(OC)cc1I	C21H22INO3	unknown
+COc1cc(CCNCc2c(O)ccc3ccccc23)c(OC)cc1I	C21H22INO3	unknown
+COc1cc(CCNCc2cc3c(cc2O)OCO3)c(OC)cc1I	C18H20INO5	unknown
+COc1cc(CCNCc2ccc3ccccc3c2O)c(OC)cc1I	C21H22INO3	unknown
+COc1cc(CCNCc2ccc3c(c2)OCO3)c(OC)cc1I	C18H20INO4	unknown
+COc1cc(CCNCc2ccc(C(F)(F)F)cc2)c(OC)cc1I	C18H19F3INO2	unknown
+COc1cc(CCNCc2ccccc2C(F)(F)F)c(OC)cc1I	C18H19F3INO2	unknown
+COc1ccc(CCNCc2ccccc2OC)c(OC)c1	C18H23NO3	unknown
+COc1ccc(CCNCc2ccccc2O)c(OC)c1	C17H21NO3	unknown
+COc1cc(CC2(N)CC2)c(OC)cc1C	C13H19NO2	unknown
+CCN(CCc1c[nH]c2ccc(OC)cc12)C(C)C	C16H24N2O	tryptamine
+COc1cc(Br)cc(CC(C)N)c1OC	C11H16BrNO2	unknown
+COc1ccc(Br)c(CC(C)N)c1OC	C11H16BrNO2	unknown
+COc1ccc(Br)c(OC)c1CC(C)N	C11H16BrNO2	unknown
+COc1cc(CC(C)N)c(Br)c(OC)c1	C11H16BrNO2	unknown
+COc1cc(OC)c(Br)c(CC(C)N)c1Br	C11H15Br2NO2	unknown
+COc1ccc(Br)c(CC(C)N)c1	C10H14BrNO	unknown
+COc1ccc(CC(C)N)cc1Br	C10H14BrNO	unknown
+COc1cc(CC(C)N)ccc1Br	C10H14BrNO	unknown
+CNC(C)Cc1cc(O)ccc1OC	C11H17NO2	unknown
+COc1ccc(I)c(OC)c1CC(C)N	C11H16INO2	unknown
+COc1cc(CC(C)N)c(OC)cc1CCCCc1ccccc1	C21H29NO2	unknown
+CCC(C(=O)c1ccccc1)N1CCCC1	C14H19NO	beta-ketone
+COc1cc(CCNCc2ccccc2OC)c(OC)cc1Br	C18H22BrNO3	unknown
+C=C(C)CSc1cc(OC)c(CCN)cc1OC	C14H21NO2S	prophetic
+COc1cc(SCC(C)C)c(OC)cc1CCN	C14H23NO2S	unknown
+COc1cc(SCc2ccccc2)c(OC)cc1CCN	C17H21NO2S	prophetic
+COc1cc(SCCCF)c(OC)cc1CCN	C13H20FNO2S	prophetic
+COc1cc(SCCCCF)c(OC)cc1CCN	C14H22FNO2S	unknown
+COc1cc(SCc2ccc(C(F)(F)F)cc2)c(OC)cc1CCN	C18H20F3NO2S	unknown
+COc1cc(SCc2c(F)c(F)c(F)c(F)c2F)c(OC)cc1CCN	C17H16F5NO2S	unknown
+COc1cccc(CSc2cc(OC)c(CCN)cc2OC)c1	C18H23NO3S	unknown
+COc1cc(CCN)cc(OC)c1OCCF	C12H18FNO3	unknown
+COc1cc(CCN)cc(OC)c1OCC(F)F	C12H17F2NO3	unknown
+COc1cc(CCN)cc(OC)c1OCC(F)(F)F	C12H16F3NO3	unknown
+COc1cc(CCN)cc(OC)c1OCCCF	C13H20FNO3	unknown
+COc1cc(CCN)cc(OC)c1OCC(C)C	C14H23NO3	unknown
+COc1cc(CC(C)N)cc(OC)c1OCCF	C13H20FNO3	unknown
+COc1cc(CC(C)N)cc(OC)c1OCC(F)F	C13H19F2NO3	unknown
+COc1cc(CC(C)N)cc(OC)c1OCC(F)(F)F	C13H18F3NO3	unknown
+COc1cc(CC(C)N)cc(OC)c1OCCCF	C14H22FNO3	unknown
+COc1cc(CC(C)N)cc(OC)c1OCC(C)C	C15H25NO3	unknown
+C=C(C)COc1c(OC)cc(CC(C)N)cc1OC	C15H23NO3	unknown
+C#Cc1cc(OC)c(CC(C)N)cc1OC	C13H17NO2	unknown
+COc1cc(CC(C)N)c(OC)cc1C#N	C12H16N2O2	unknown
+C=Cc1cc(OC)c(CCN)cc1OC	C12H17NO2	prophetic
+COc1cc(-c2ccccc2)c(OC)cc1CCN	C16H19NO2	unknown
+COc1cc(-c2ccccc2OC)c(OC)cc1CCN	C17H21NO3	unknown
+COc1cc(-c2ccccc2C)c(OC)cc1CCN	C17H21NO2	unknown
+COc1cc(-c2ccccc2C(F)(F)F)c(OC)cc1CCN	C17H18F3NO2	unknown
+COc1cc(-c2ccc3ccccc3c2)c(OC)cc1CCN	C20H21NO2	unknown
+COc1cccc(-c2cc(OC)c(CCN)cc2OC)c1	C17H21NO3	unknown
+COc1cc(-c2cccc([N+](=O)[O-])c2)c(OC)cc1CCN	C16H18N2O4	unknown
+COc1ccc(-c2cc(OC)c(CCN)cc2OC)cc1	C17H21NO3	unknown
+CCCCc1ccc(-c2cc(OC)c(CCN)cc2OC)cc1	C20H27NO2	unknown
+COc1cc(-c2ccc(C(F)(F)F)cc2)c(OC)cc1CCN	C17H18F3NO2	unknown
+COc1cc(-c2ccc(-c3ccccc3)cc2)c(OC)cc1CCN	C22H23NO2	unknown
+COc1cc(-c2ccc(OC)c(OC)c2)c(OC)cc1CCN	C18H23NO4	unknown
+COc1cc(-c2ccccc2OC)ccc1CCN	C16H19NO2	unknown
+NCCc1ccc2c(c1)OC(F)(F)O2	C9H9F2NO2	unknown
+CNC(C)Cc1ccc2c(c1)OC(F)(F)O2	C11H13F2NO2	unknown
+CCNC(C)Cc1ccc2c(c1)OC(F)(F)O2	C12H15F2NO2	unknown
+CCC(N)Cc1ccc2c(c1)OC(F)(F)O2	C11H13F2NO2	unknown
+CCC(Cc1ccc2c(c1)OC(F)(F)O2)NC	C12H15F2NO2	unknown
+CC(N)Cc1ccc2c(c1)OC(F)(F)O2	C10H11F2NO2	unknown
+COc1cc(CCNCc2ccccc2F)c(OC)cc1I	C17H19FINO2	unknown
+COc1cc(CCNCc2ccc(F)cc2)c(OC)cc1I	C17H19FINO2	unknown
+COc1cc(CCNCc2ccccc2)c(OC)cc1I	C17H20INO2	unknown
+COc1cc(CC(C)N)c(OC)cc1CCCc1ccccc1	C20H27NO2	unknown
+COc1cc(CC(C)N)c(OC)cc1CCc1ccccc1	C19H25NO2	unknown
+COc1cc(CC(C)N)c(OC)cc1CCCc1ccc(Cl)cc1	C20H26ClNO2	unknown
+COc1ccc(CCCc2cc(OC)c(CC(C)N)cc2OC)cc1	C21H29NO3	unknown
+COc1cc(CCCc2ccccc2)c(OC)cc1CCN	C19H25NO2	unknown
+COc1cc(CCc2ccccc2)c(OC)cc1CCN	C18H23NO2	unknown
+COc1cc(CCCCc2ccccc2)c(OC)cc1CCN	C20H27NO2	unknown
+CCN(CC)C(C)C(=O)c1ccccc1	C13H19NO	beta-ketone
+COc1cc(CCCc2ccccc2)ccc1CC(C)N	C19H25NO	unknown
+COc1cc(CC(C)N)ccc1CCCc1ccccc1	C19H25NO	unknown
+COc1c(CCCc2ccccc2)ccc(CC(C)N)c1OC	C20H27NO2	unknown
+COc1cc(CC(C)N)cc(OC)c1CCCc1ccccc1	C20H27NO2	unknown
+COc1cc(CCCc2ccccc2)cc(OC)c1CC(C)N	C20H27NO2	unknown
+CC(N)Cc1ccc(CCCc2ccccc2)cc1	C18H23N	unknown
+NCCc1ccc(CCCc2ccccc2)cc1	C17H21N	unknown
+CCC(NC)C(=O)c1ccccc1	C11H15NO	beta-ketone
+CC(NC(C)(C)C)C(=O)c1cccc(Cl)c1	C13H18ClNO	beta-ketone
+CCNC(C)C(=O)c1ccc2c(c1)OCO2	C12H15NO3	beta-ketone
+CCCC(NC)C(=O)c1ccc2c(c1)OCO2	C13H17NO3	beta-ketone
+CCCC(C(=O)c1ccccc1)N1CCCC1	C15H21NO	beta-ketone
+CCC(C(=O)c1ccc2c(c1)OCO2)N1CCCC1	C15H19NO3	beta-ketone
+CCCC(C(=O)c1ccc2ccccc2c1)N1CCCC1	C19H23NO	beta-ketone
+CNC(C)C(=O)c1ccc(Br)cc1	C10H12BrNO	beta-ketone
+CCNC(CC)C(=O)c1ccc2c(c1)OCO2	C13H17NO3	beta-ketone
+COCCOc1c(OC)cc(CCN)cc1OC	C13H21NO4	unknown
+CC(N)Cc1ccc2c(c1)OCC2	C11H15NO	unknown
+CC(N)Cc1ccc2c(c1)CCO2	C11H15NO	unknown
+CC(N)Cc1ccc2ccccc2c1	C13H15N	unknown
+CC(N)Cc1ccc2c(c1)CCCC2	C13H19N	unknown
+CC(N)Cc1ccc(I)cc1	C9H12IN	unknown
+NC1Cc2ccc(I)cc2C1	C9H10IN	unknown
+NC1Cc2ccccc2C1	C9H11N	unknown
+CCc1cc(OC)c(CC(N)CC)cc1OC	C14H23NO2	unknown
+CCC(N)Cc1cc(OC)c(C(C)C)cc1OC	C15H25NO2	unknown
+COc1cc(C)c(OC)c2c1CC(N)C2	C12H17NO2	unknown
+CCC(N)Cc1cc(OC)c(SC)cc1OC	C13H21NO2S	unknown
+CCCc1cc(OC)c(CC(N)CC)cc1OC	C15H25NO2	unknown
+COc1cc(C)c(OC)c2c1CC(N)CC2	C13H19NO2	unknown
+CCCCc1cc(OC)c(CC(N)CC)cc1OC	C16H27NO2	unknown
+CCC(N)Cc1cc(OC)c(O)cc1OC	C12H19NO3	unknown
+NC1Cc2ccc3c(c2C1)OCO3	C10H11NO2	unknown
+CCOc1cc(OC)c(CC(N)CC)cc1OC	C14H23NO3	unknown
+CCCOc1cc(OC)c(CC(N)CC)cc1OC	C15H25NO3	unknown
+N[C@H]1CCc2c(ccc3c2OCO3)C1	C11H13NO2	unknown
+CCC(N)Cc1cc(OC)c(OC(C)C)cc1OC	C15H25NO3	unknown
+CCC(N)Cc1cc(OC)c([N+](=O)[O-])cc1OC	C12H18N2O4	unknown
+NC1CCc2cc3c(cc2C1)OCO3	C11H13NO2	unknown
+CCC(N)Cc1cc(OC)c(N)cc1OC	C12H20N2O2	unknown
+CCC(N)Cc1cc(OC)c(Cl)cc1OC	C12H18ClNO2	unknown
+NC1CCc2cc(Cl)ccc2C1	C10H12ClN	unknown
+COc1cc(CCN)cc(OC)c1Br	C10H14BrNO2	unknown
+NC1CCc2ccccc2C1	C10H13N	unknown
+CC(N)Cc1ccc2ccoc2c1	C11H13NO	unknown
+CC(N)Cc1ccc2occc2c1	C11H13NO	unknown
+COc1ccccc1CNCCc1cc(OC)c(OC)c(OC)c1	C19H25NO4	unknown
+C=CCNCCc1c[nH]c2ccc(OC)cc12	C14H18N2O	tryptamine
+C#CCN(CC#C)CCc1c[nH]c2ccc(OC)cc12	C17H18N2O	tryptamine
+C=CCN(CC=C)CCc1c[nH]c2cccc(O)c12	C16H20N2O	tryptamine
+C=CCN(CC=C)CCc1c[nH]c2cccc(OC(C)=O)c12	C18H22N2O2	tryptamine
+CCN(C)CCc1c[nH]c2cccc(OC(C)=O)c12	C15H20N2O2	tryptamine
+C=CCN(CC=C)CCc1c[nH]c2cccc(OC)c12	C17H22N2O	tryptamine
+CC(N)Cc1ccc2[nH]ccc2c1	C11H14N2	unknown
+COc1cc(CCNCc2ccccc2OC)c(OC)cc1C	C19H25NO3	unknown
+COc1cc(CCNCc2ccccc2OC)c(OC)cc1Cl	C18H22ClNO3	unknown
+Oc1cccc2[nH]cc(CCN(Cc3ccccc3)Cc3ccccc3)c12	C24H24N2O	tryptamine
+CN(CCc1c[nH]c2cccc(O)c12)C1CCCC1	C16H22N2O	tryptamine
+CC1CCCC(C)N1CCc1c[nH]c2cccc(O)c12	C17H24N2O	tryptamine
+Oc1cccc2[nH]cc(CCN3CCC(c4ccccc4)CC3)c12	C21H24N2O	tryptamine
+Oc1cccc2[nH]cc(CCN3CCC(O)(c4ccc(F)cc4)CC3)c12	C21H23FN2O2	tryptamine
+CNC(C)C(=O)c1ccc(C)c(C)c1	C12H17NO	beta-ketone
+COc1cc(C(C)C)c(OC)cc1CCN	C13H21NO2	unknown
+CCC(NC)C(=O)c1ccc(C)cc1	C12H17NO	beta-ketone
+COc1ccccc1CCN	C9H13NO	unknown
+COc1ccc(Br)cc1CCN	C9H12BrNO	unknown
+CCC(N)Cc1ccccc1	C10H15N	unknown
+CCC(NC)C(=O)c1ccc(F)cc1	C11H14FNO	beta-ketone
+CCc1ccc(C(=O)C(CC)N2CCCC2)cc1	C16H23NO	beta-ketone
+CCC(C(=O)c1ccc(OC)cc1)N1CCCC1	C15H21NO2	beta-ketone
+CNC(C)C(=O)c1ccc(OC)c(C)c1	C12H17NO2	beta-ketone
+CCC(=O)Oc1cccc2[nH]cc(CCN(C(C)C)C(C)C)c12	C19H28N2O2	tryptamine
+CCNC(CC)C(=O)c1ccc(C)cc1	C13H19NO	beta-ketone
+CNCCc1ccccc1	C9H13N	unknown
+COc1cccc2[nH]cc(CCN)c12	C11H14N2O	tryptamine
+CNCCc1c[nH]c2cccc(OC)c12	C12H16N2O	tryptamine
+CCC(=O)c1cccc2[nH]cc(CCN(C(C)C)C(C)C)c12	C19H28N2O	tryptamine
+CCNC(C)C(=O)c1ccc(C)cc1	C12H17NO	beta-ketone
+CCc1ccc(C(=O)C(C)NC)cc1	C12H17NO	beta-ketone
+CCc1ccc(C(=O)C(C)N)cc1	C11H15NO	beta-ketone
+CCC(NC)C(=O)c1ccc2c(c1C)OCO2	C13H17NO3	beta-ketone
+CCC(NC)C(=O)c1cc(C)c2c(c1)OCO2	C13H17NO3	beta-ketone
+COc1cc(Br)c2c(c1CCN)CCO2	C11H14BrNO2	unknown
+COc1cc(CCN)c2c(c1Br)CCO2	C11H14BrNO2	unknown
+NCCc1c2c(c(Br)c3c1OCCC3)OCCC2	C14H18BrNO2	unknown
+COc1cc(CC(C)N)c2c(c1I)CCO2	C12H16INO2	unknown
+CC(N)Cc1c2c(c(Br)c3c1OCCC3)OCCC2	C15H20BrNO2	unknown
+CC(N)Cc1c2c(c(Br)c3ccoc13)OCCC2	C14H16BrNO2	unknown
+COc1cc(CCN)c2c(c1OC)OCC2	C12H17NO3	unknown
+COc1c2c(c(CCN)c3c1OCC3)CCO2	C13H17NO3	unknown
+NCCc1c2c(c(Br)c3ccoc13)OCCC2	C13H14BrNO2	unknown
+NCCc1c2c(c(Br)c3occc13)CCCO2	C13H14BrNO2	unknown
+CNC(C)Cc1c2c(c(Br)c3c1OCC3)OCC2	C14H18BrNO2	unknown
+CC(N)Cc1c2c(c(Br)c3c1OCC3)OCCC2	C14H18BrNO2	unknown
+CC(N)Cc1c2c(c(Br)c3occc13)CCCO2	C14H16BrNO2	unknown
+CNC(C)Cc1c2ccoc2c(Br)c2ccoc12	C14H14BrNO2	unknown
+COc1cc2c(c(OC)c1OC)CCC2CN	C13H19NO3	unknown
+COc1cc(Br)c(OC)c2c1C(CN)CC2	C12H16BrNO2	unknown
+CCc1cc(OC)c(CCNCc2ccccc2OC)cc1OC	C20H27NO3	unknown
+COc1cc(SC(C)C)c(OC)cc1CCNCc1ccccc1OC	C21H29NO3S	unknown
+COc1ccccc1CNCCc1cc(OC)c(C)c(C)c1OC	C20H27NO3	unknown
+CC(=O)Oc1cccc2[nH]cc(CCN(C)C(C)C)c12	C16H22N2O2	tryptamine
+CNCC(O)c1ccc(O)cc1	C9H13NO2	unknown
+CNCC(O)c1ccccc1O	C9H13NO2	unknown
+CC(C)(C)NCC(O)c1ccc(O)c(CO)c1	C13H21NO3	unknown
+CC(C)(C)NCC(O)c1cc(Cl)c(N)c(Cl)c1	C12H18Cl2N2O	unknown
+COc1ccc(OC)c(CCN2CCc3ccccc3C2)c1	C19H23NO2	unknown
+COc1cc(CCN2CCc3ccccc3C2)c(OC)cc1Br	C19H22BrNO2	unknown
+CC(CN)c1ccccc1	C9H13N	unknown
+CCN(C)CCc1c[nH]c2ccc(OC)cc12	C14H20N2O	tryptamine
+COc1cc(CCNCc2ccccc2OC)c(OC)cc1CCF	C20H26FNO3	unknown
+COc1cc(C(F)(F)F)c(OC)cc1CCNCc1ccccc1OC	C19H22F3NO3	unknown
+COc1cccc2c(CCN(C(C)C)C(C)C)c[nH]c12	C17H26N2O	tryptamine
+CCCN(CCC)CCc1c[nH]c2cccc(OC(C)=O)c12	C18H26N2O2	tryptamine
+CNC(C)Cc1ccc2c(c1)CCC2	C13H19N	unknown
+CCCCN(CCCC)CCc1c[nH]c2cccc(OC(C)=O)c12	C20H30N2O2	tryptamine
+Cc1ccc(CCN)cc1C	C10H15N	unknown
+CCCN(C)CCc1c[nH]c2cccc(OC(C)=O)c12	C16H22N2O2	tryptamine
+CCOc1ccccc1CNCCc1c[nH]c2ccccc12	C19H22N2O	tryptamine
+COc1ccccc1C(C)NCCc1c[nH]c2ccccc12	C19H22N2O	tryptamine
+COc1ccc2[nH]cc(CCNCc3ccccc3)c2c1	C18H20N2O	tryptamine
+COc1ccc2[nH]cc(CCNCc3ccccc3O)c2c1	C18H20N2O2	tryptamine
+COc1ccc2[nH]cc(CCNCc3ccccc3OC(F)(F)F)c2c1	C19H19F3N2O2	tryptamine
+c1ccc(CNCCc2c[nH]c3ccccc23)cc1	C17H18N2	tryptamine
+Oc1ccccc1CNCCc1c[nH]c2ccccc12	C17H18N2O	tryptamine
+COc1ccccc1CNCCc1c[nH]c2ccccc12	C18H20N2O	tryptamine
+CC(C)NC(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C19H23N3O	unknown
+CCN(C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1)C(C)C	C21H27N3O	unknown
+COc1cc(CC(C)N)c(O)cc1C	C11H17NO2	unknown
+COc1cc(C)c(O)cc1CC(C)N	C11H17NO2	unknown
+CC(N)Cc1c2ccccc2c(Br)c2ccccc12	C17H16BrN	unknown
+NCCc1c2c(c(C(F)(F)F)c3c1OCC3)OCC2	C13H14F3NO2	unknown
+NCCc1c2ccoc2c(C(F)(F)F)c2ccoc12	C13H10F3NO2	unknown
+COc1cc(Br)c2occc2c1CCN	C11H12BrNO2	unknown
+COc1cc(CCN)c2occc2c1Br	C11H12BrNO2	unknown
+COc1cc(Br)c2occc2c1CC(C)N	C12H14BrNO2	unknown
+COc1cc(CC(C)N)c2occc2c1Br	C12H14BrNO2	unknown
+COc1cc(Br)c2c(c1CC(C)N)CCO2	C12H16BrNO2	unknown
+COc1cc(CC(C)N)c2c(c1Br)CCO2	C12H16BrNO2	unknown
+CC(N)Cc1c2ccoc2c(C(F)(F)F)c2ccoc12	C14H12F3NO2	unknown
+CC(N)Cc1c2ccoc2cc2ccoc12	C13H13NO2	unknown
+COc1cc(Cl)ccc1CC(C)N	C10H14ClNO	unknown
+COc1cc(CC(C)N)ccc1Cl	C10H14ClNO	unknown
+CC(N)Cc1cc(Cl)c(Cl)cc1Cl	C9H10Cl3N	unknown
+CC(N)Cc1ccc(Cl)cc1Cl	C9H11Cl2N	unknown
+CC(N)Cc1cc(Cl)c(Br)cc1Cl	C9H10BrCl2N	unknown
+COc1ccc2c(c1)CCC(N)C2	C11H15NO	unknown
+COc1ccc2c(c1)CC(N)CC2	C11H15NO	unknown
+NC1CCc2ccc(O)cc2C1	C10H13NO	unknown
+COc1ccc(OC)c2c1CCC(N)C2	C12H17NO2	unknown
+CCCN(CCC)C1CCc2cccc(O)c2C1	C16H25NO	unknown
+CNC1CCc2cc3c(cc2C1)OCO3	C12H15NO2	unknown
+COc1cc2c(cc1C)CCC(N)C2	C12H17NO	unknown
+COc1ccc2c(c1)CC(N)C2	C10H13NO	unknown
+NC1Cc2ccc(C(F)(F)F)cc2C1	C10H10F3N	unknown
+CCNC1Cc2ccc(C(F)(F)F)cc2C1	C12H14F3N	unknown
+CCNC(C)Cc1cccc(C(F)(F)F)c1	C12H16F3N	unknown
+CC(N)Cc1cccc(C(F)(F)F)c1	C10H12F3N	unknown
+CCC(NC)C(=O)c1ccc(OC)cc1	C12H17NO2	beta-ketone
+CC(N)Cc1cccc(O)c1	C9H13NO	unknown
+COc1cc(I)cc(OC)c1CCN	C10H14INO2	unknown
+CCc1cc(OC)c(CCN)c(OC)c1	C12H19NO2	unknown
+COc1cc(Br)cc(OC)c1CCN	C10H14BrNO2	unknown
+COc1cc(CCF)c(OC)cc1CCN	C12H18FNO2	unknown
+COc1cc(SC)cc(OC)c1CCN	C11H17NO2S	unknown
+COc1cc(SC)cc(OC)c1CC(C)N	C12H19NO2S	unknown
+COc1cc(Br)cc(OC)c1CC(C)N	C11H16BrNO2	unknown
+CCc1cc(OC)c(CC(C)N)c(OC)c1	C13H21NO2	unknown
+COc1cc(I)cc(OC)c1CC(C)N	C11H16INO2	unknown
+COc1cc(C)cc(OC)c1CCN	C11H17NO2	unknown
+COc1cc(C(C)C)c(OC)cc1CCNCc1ccccc1OC	C21H29NO3	unknown
+C=CCOc1c(OC)cc(CCNCc2ccccc2OC)cc1OC	C21H27NO4	unknown
+COc1cc(CC(C)NCc2ccccc2)c(OC)cc1Br	C18H22BrNO2	unknown
+COc1cc(CC(C)NCCCCc2ccccc2)c(OC)cc1Br	C21H28BrNO2	unknown
+CCNC(C)Cc1cc(OC)c(Br)cc1OC	C13H20BrNO2	unknown
+COc1cc(C(OC)C(C)N)c(OC)cc1Br	C12H18BrNO3	unknown
+COc1cc(C(O)C(C)N)c(OC)cc1Br	C11H16BrNO3	unknown
+Cc1c2c(c(CCN)c3c1OCCC3)OCCC2	C15H21NO2	unknown
+COc1cc2c(c(CC(C)N)c1)OCC2	C12H17NO2	unknown
+COc1ccccc1CNC(C)Cc1c2c(c(Br)c3c1OCC3)OCC2	C21H24BrNO3	unknown
+COc1ccc(CNCCc2c[nH]c3ccc(OC)cc23)cc1	C19H22N2O2	tryptamine
+COc1ccc2[nH]cc(CCNCc3ccc([N+](=O)[O-])cc3)c2c1	C18H19N3O3	tryptamine
+COc1ccc2[nH]cc(CCNCc3ccc(N)cc3)c2c1	C18H21N3O	tryptamine
+COc1ccc2[nH]cc(CCNCc3ccc(C)cc3)c2c1	C19H22N2O	tryptamine
+COc1ccc2[nH]cc(CCNCc3ccc(I)cc3)c2c1	C18H19IN2O	tryptamine
+COc1ccc2[nH]cc(CCNCc3ccc(Br)cc3)c2c1	C18H19BrN2O	tryptamine
+COc1ccc2[nH]cc(CCNCc3ccc(Cl)cc3)c2c1	C18H19ClN2O	tryptamine
+COc1ccc2[nH]cc(CCNCc3ccc(F)cc3)c2c1	C18H19FN2O	tryptamine
+CCNCCc1c[nH]c2ccc(OC)cc12	C13H18N2O	tryptamine
+COc1ccc2[nH]cc(CCNCCCCc3ccccc3)c2c1	C21H26N2O	tryptamine
+COc1ccc2[nH]cc(CCNCCCc3ccccc3)c2c1	C20H24N2O	tryptamine
+COc1cc(CCNCCCCc2ccccc2)c(OC)cc1Br	C20H26BrNO2	unknown
+COc1ccc(CNCCc2cc(OC)c(Br)cc2OC)cc1	C18H22BrNO3	unknown
+COc1cc(CCNCc2ccc([N+](=O)[O-])cc2)c(OC)cc1Br	C17H19BrN2O4	unknown
+COc1cc(CCNCc2ccc(N)cc2)c(OC)cc1Br	C17H21BrN2O2	unknown
+COc1cc(CCNCc2ccc(C)cc2)c(OC)cc1Br	C18H22BrNO2	unknown
+COc1cc(CCNCc2ccc(I)cc2)c(OC)cc1Br	C17H19BrINO2	unknown
+COc1cc(CCNCc2ccc(Br)cc2)c(OC)cc1Br	C17H19Br2NO2	unknown
+COc1cc(CCNCc2ccc(Cl)cc2)c(OC)cc1Br	C17H19BrClNO2	unknown
+COc1cc(CCNCc2ccc(F)cc2)c(OC)cc1Br	C17H19BrFNO2	unknown
+COc1cc(CCN2CCCCC2)c(OC)cc1Br	C15H22BrNO2	unknown
+COc1cc(CCNCc2ccccc2)c(OC)cc1Br	C17H20BrNO2	unknown
+COc1cc(CCNCCCc2ccccc2)c(OC)cc1Br	C19H24BrNO2	unknown
+CCNCCc1cc(OC)c(Br)cc1OC	C12H18BrNO2	unknown
+COc1cc(CCN(C)C)c(OC)cc1Br	C12H18BrNO2	unknown
+CNCCc1cc(OC)c(Br)cc1OC	C11H16BrNO2	unknown
+C=Cc1cc(OC)c(CC(C)N)cc1OC	C13H19NO2	unknown
+CCC(N)Cc1c2c(c(Br)c3c1OCC3)OCC2	C14H18BrNO2	unknown
+CCC(N)Cc1c2c(cc3c1OCC3)OCC2	C14H19NO2	unknown
+COc1cc(CC(C)NCc2ccccc2O)c(OC)cc1I	C18H22INO3	unknown
+COc1cc(CCNCc2ccccc2OC(F)(F)F)c(OC)cc1Br	C18H19BrF3NO3	unknown
+COc1cc(CCN(C)Cc2ccccc2OC)c(OC)cc1Br	C19H24BrNO3	unknown
+COc1cc(CC(C)NCc2ccccc2OC)c(OC)cc1Br	C19H24BrNO3	unknown
+COc1cc(CC(C)NCc2ccccc2O)c(OC)cc1Br	C18H22BrNO3	unknown
+COc1cc(C(F)(F)F)c(OC)cc1CCNCc1ccccc1O	C18H20F3NO3	unknown
+COc1cc(CCNCc2ccccc2O)c(OC)cc1Br	C17H20BrNO3	unknown
+CCC(Cc1c2c(c(Br)c3c1OCC3)OCC2)NCc1ccccc1OC	C22H26BrNO3	unknown
+CC(Cc1c2c(c(Br)c3c1OCC3)OCC2)NCc1ccccc1O	C20H22BrNO3	unknown
+COc1cc(CC(C)N(C)C)c(OC)cc1Br	C13H20BrNO2	unknown
+COc1cc(C(C)=O)c(OC)cc1CC(C)N	C13H19NO3	unknown
+COc1cc(C(=O)O)c(OC)cc1CC(C)N	C12H17NO4	unknown
+COc1cc(CC(C)N)c(OC)cc1O	C11H17NO3	unknown
+CCCNC(=O)c1cc(OC)c(CC(C)N)cc1OC	C15H24N2O3	unknown
+CCC(=O)c1cc(OC)c(CC(C)N)cc1OC	C14H21NO3	unknown
+CCCCOC(=O)c1cc(OC)c(CC(C)N)cc1OC	C16H25NO4	unknown
+CCCOC(=O)c1cc(OC)c(CC(C)N)cc1OC	C15H23NO4	unknown
+CCCCCCCCc1cc(OC)c(CC(C)N)cc1OC	C19H33NO2	unknown
+COC(c1ccc(SC)cc1)C(C)N	C11H17NOS	unknown
+COc1ccc(C(OC)C(C)N)cc1	C11H17NO2	unknown
+COC(c1ccc(C)cc1)C(C)N	C11H17NO	unknown
+COC(c1ccccc1)C(C)N	C10H15NO	unknown
+Cc1ccc(C(O)C(C)N)cc1	C10H15NO	unknown
+CCCCSc1ccc(C(O)C(C)N)cc1	C13H21NOS	unknown
+CCCSc1ccc(C(O)C(C)N)cc1	C12H19NOS	unknown
+CCSc1ccc(C(O)C(C)N)cc1	C11H17NOS	unknown
+CSc1ccc(C(O)C(C)N)cc1	C10H15NOS	unknown
+CCCCOc1ccc(C(O)C(C)N)cc1	C13H21NO2	unknown
+CCCOc1ccc(C(O)C(C)N)cc1	C12H19NO2	unknown
+CCOc1ccc(C(O)C(C)N)cc1	C11H17NO2	unknown
+COc1ccc(C(O)C(C)N)cc1	C10H15NO2	unknown
+CC(C)CSc1ccc(C(O)C(C)N)cc1	C13H21NOS	unknown
+COc1ccc(OC)c(C(O)C(C)N)c1	C11H17NO3	unknown
+C[C@H](N)[C@H](O)c1ccccc1	C9H13NO	unknown
+COc1ccc(OC)c(C(=O)C(C)N)c1	C11H15NO3	beta-ketone
+CC(C)CSc1ccc(C(=O)C(C)N)cc1	C13H19NOS	beta-ketone
+CCCCSc1ccc(C(=O)C(C)N)cc1	C13H19NOS	beta-ketone
+CCCSc1ccc(C(=O)C(C)N)cc1	C12H17NOS	beta-ketone
+CCSc1ccc(C(=O)C(C)N)cc1	C11H15NOS	beta-ketone
+CSc1ccc(C(=O)C(C)N)cc1	C10H13NOS	beta-ketone
+CC(C)COc1ccc(C(=O)C(C)N)cc1	C13H19NO2	beta-ketone
+CCCCOc1ccc(C(=O)C(C)N)cc1	C13H19NO2	beta-ketone
+CCCOc1ccc(C(=O)C(C)N)cc1	C12H17NO2	beta-ketone
+CCOc1ccc(C(=O)C(C)N)cc1	C11H15NO2	beta-ketone
+COc1ccc(C(=O)C(C)N)cc1	C10H13NO2	beta-ketone
+Cc1ccc(C(=O)C(C)N)cc1	C10H13NO	beta-ketone
+CCC(C(=O)c1ccc2c(c1)OCO2)N(C)C	C13H17NO3	beta-ketone
+NCC(CC(=O)O)c1ccc(Cl)cc1	C10H12ClNO2	unknown
+NCC(CC(=O)O)c1ccccc1	C10H13NO2	unknown
+COc1cc(CC(C)[N+](C)(C)C)c(OC)cc1Br	C14H23BrNO2	unknown
+COc1cc(CCN)cc(OC)c1O	C10H15NO3	unknown
+CC(N)Cc1ccc(O)c(O)c1	C9H13NO2	unknown
+COc1cccc(CCN)c1OC	C10H15NO2	unknown
+COc1cccc(OC)c1CCN	C10H15NO2	unknown
+COc1cc(CCN)cc(OC)c1	C10H15NO2	unknown
+NCCc1ccco1	C6H9NO	unknown
+COc1cc(CC(C)N)ccc1O	C10H15NO2	unknown
+COc1c(CCN)c(OC)c(OC)c(OC)c1OC	C13H21NO5	unknown
+CNC(C)Cc1cc(OC)c(OC)c(OC)c1OC	C14H23NO4	unknown
+COc1cc(CCN)c(OC)c(OC)c1OC	C12H19NO4	unknown
+COc1cc(OC)c(OC)c(CCN)c1OC	C12H19NO4	unknown
+c1ccc(N2CCNCC2)cc1	C10H14N2	unknown
+FC(F)(F)c1ccccc1N1CCNCC1	C11H13F3N2	unknown
+FC(F)(F)c1cccc(N2CCNCC2)c1	C11H13F3N2	unknown
+FC(F)(F)c1ccc(N2CCNCC2)cc1	C11H13F3N2	unknown
+Clc1ccccc1N1CCNCC1	C10H13ClN2	unknown
+Clc1cccc(N2CCNCC2)c1	C10H13ClN2	unknown
+Oc1ccc(N2CCNCC2)cc1Cl	C10H13ClN2O	unknown
+Clc1ccc(N2CCNCC2)cc1	C10H13ClN2	unknown
+Fc1ccc(N2CCNCC2)cc1	C10H13FN2	unknown
+Oc1ccc(N2CCNCC2)cc1	C10H14N2O	unknown
+COc1ccccc1N1CCNCC1	C11H16N2O	unknown
+COc1cccc(N2CCNCC2)c1	C11H16N2O	unknown
+COc1ccc(N2CCNCC2)cc1	C11H16N2O	unknown
+c1ccc2c(N3CCNCC3)cccc2c1	C14H16N2	unknown
+c1ccc2nc(N3CCNCC3)ccc2c1	C13H15N3	unknown
+c1cnc(N2CCNCC2)nc1	C8H12N4	unknown
+COc1cc(CN2CCNCC2)c(OC)cc1Br	C13H19BrN2O2	unknown
+CCCNC(C)c1ccc2c(c1)OCO2	C12H17NO2	unknown
+CCNC(C)c1ccc2c(c1)OCO2	C11H15NO2	unknown
+CC(c1ccc2c(c1)OCO2)N(C)C	C11H15NO2	unknown
+CNC(C)c1ccc2c(c1)OCO2	C10H13NO2	unknown
+CN(C)C(C)(C)c1ccc2c(c1)OCO2	C12H17NO2	unknown
+CNC(C)(C)c1ccc2c(c1)OCO2	C11H15NO2	unknown
+CC(C)(N)c1ccc2c(c1)OCO2	C10H13NO2	unknown
+CC(N)c1ccc2c(c1)OCO2	C9H11NO2	unknown
+CN(C)Cc1ccc2c(c1)OCO2	C10H13NO2	unknown
+CNCc1ccc2c(c1)OCO2	C9H11NO2	unknown
+c1cc2c(cc1CN1CCNCC1)OCO2	C12H16N2O2	unknown
+NCc1ccc(O)c(O)c1	C7H9NO2	unknown
+O=[N+]([O-])c1ccc(CN2CCNCC2)cc1	C11H15N3O2	unknown
+COc1ccc(CN)cc1	C8H11NO	unknown
+NCc1ccc(Cl)cc1	C7H8ClN	unknown
+Clc1ccc(CN2CCNCC2)cc1	C11H15ClN2	unknown
+CN1CCN(Cc2ccccc2)CC1	C12H18N2	unknown
+c1ccc(CN2CCNCC2)cc1	C11H16N2	unknown
+CC(N)c1ccccc1	C8H11N	unknown
+NCc1ccccc1	C7H9N	unknown
+CNC(C)CCc1ccc2c(c1)OCO2	C12H17NO2	unknown
+CC(N)CCc1ccc2c(c1)OCO2	C11H15NO2	unknown
+CC(C)NC(C)c1ccc2c(c1)OCO2	C12H17NO2	unknown
+CC(C)NC(C)CCc1ccc2c(c1)OCO2	C14H21NO2	unknown
+CCNC(C)CCc1ccc2c(c1)OCO2	C13H19NO2	unknown
+CC(CCc1ccc2c(c1)OCO2)N(C)C	C13H19NO2	unknown
+COc1ccc(CCC(C)N)cc1OC	C12H19NO2	unknown
+NCCCc1ccc(O)c(O)c1	C9H13NO2	unknown
+COc1ccc(CCC(C)N)cc1	C11H17NO	unknown
+CCN(CC)CCCc1cccc(OC)c1	C14H23NO	unknown
+CCNCCCc1cccc(OC)c1	C12H19NO	unknown
+CC(N)CCc1ccc(Cl)cc1	C10H14ClN	unknown
+CNCC(C)Cc1ccccc1	C11H17N	unknown
+NCCCc1ccccc1	C9H13N	unknown
+CC(CCc1ccc2c(c1)OCO2)NO	C11H15NO3	unknown
+CNCCCc1cc(OC)ccc1OC	C12H19NO2	unknown
+COc1ccc(OC)c(CCCN(C)C)c1	C13H21NO2	unknown
+COc1cc(CCCN)cc(OC)c1OC	C12H19NO3	unknown
+COc1cc(OC)c(OC)cc1CCC(C)N	C13H21NO3	unknown
+COc1cc(CCC(C)N)c(OC)cc1C	C13H21NO2	unknown
+COc1ccc(CCC(C)N)c(OC)c1OC	C13H21NO3	unknown
+COc1cc(OC)c(CCC(C)N)c(OC)c1	C13H21NO3	unknown
+CCCNC(C)CCc1ccc2c(c1)OCO2	C14H21NO2	unknown
+NCCc1c2c(c(CCF)c3c1OCC3)OCC2	C14H18FNO2	unknown
+CNC(C)C(=O)c1ccc(Cl)cc1	C10H12ClNO	beta-ketone
+COc1cc(CCNCc2ccccc2OC)c(OC)cc1C#N	C19H22N2O3	unknown
+COc1cc(CCNCc2ccccc2OC)c(OC)cc1F	C18H22FNO3	unknown
+CCNC(CC)C(=O)c1ccccc1	C12H17NO	beta-ketone
+COc1cc(CC(C)NO)c(OC)cc1Br	C11H16BrNO3	unknown
+COc1cc(CCNO)c(OC)cc1Br	C10H14BrNO3	unknown
+COc1cc(CCNCc2cscc2OC)c(OC)cc1I	C16H20INO3S	unknown
+COc1cc(CCNCc2sccc2OC)c(OC)cc1I	C16H20INO3S	unknown
+CCCSc1cc(OC)c(CCNCc2ccccc2O)cc1OC	C20H27NO3S	unknown
+COc1ccccc1CNC(C)Cc1cc(OC)c(OC)cc1OC	C20H27NO4	unknown
+COc1cc(F)c(CCN)c(F)c1OC	C10H13F2NO2	unknown
+COc1cc([N+](=O)[O-])c(OC)cc1CCNCc1ccccc1OC	C18H22N2O5	unknown
+COc1cc(CCNCc2cccc3c2OCO3)c(OC)cc1Br	C18H20BrNO4	unknown
+COc1cc(CCNCc2cccc(C)c2OC)c(OC)cc1Br	C19H24BrNO3	unknown
+CCOc1c(OC)cc(CCNCc2ccccc2OC)cc1OC	C20H27NO4	unknown
+CCCC(NC)C(=O)c1ccccc1	C12H17NO	beta-ketone
+CN(C)CCc1ccccc1	C10H15N	unknown
+CCNCCc1ccccc1	C10H15N	unknown
+CCCNCCc1ccccc1	C11H17N	unknown
+CC(C)NCCc1ccccc1	C11H17N	unknown
+c1ccc(CCN2CCCCC2)cc1	C13H19N	unknown
+CNCC(C)c1ccccc1	C10H15N	unknown
+CCNCC(C)c1ccccc1	C11H17N	unknown
+NCC(O)c1ccccc1	C8H11NO	unknown
+CN(C)CC(O)c1ccccc1	C10H15NO	unknown
+NCC(=O)c1ccccc1	C8H9NO	beta-ketone
+CNCC(=O)c1ccccc1	C9H11NO	beta-ketone
+CN(C)CC(=O)c1ccccc1	C10H13NO	beta-ketone
+CCNC(C)Cc1ccccc1	C11H17N	unknown
+CCN(CC)C(C)Cc1ccccc1	C13H21N	unknown
+CCCNC(C)Cc1ccccc1	C12H19N	unknown
+CCCCNC(C)Cc1ccccc1	C13H21N	unknown
+CC(Cc1ccccc1)NO	C9H13NO	unknown
+C[C@H](N)[C@@H](O)c1ccccc1	C9H13NO	unknown
+CC1NCCOC1c1ccccc1	C11H15NO	unknown
+CC(C(=O)c1ccccc1)N1CCCCC1	C14H19NO	beta-ketone
+CC(C(=O)c1ccccc1)N1CCN(C)CC1	C14H20N2O	beta-ketone
+CCCNC(C)C(=O)c1ccccc1	C12H17NO	beta-ketone
+CC(C)NC(C)C(=O)c1ccccc1	C12H17NO	beta-ketone
+CCCCNC(C)C(=O)c1ccccc1	C13H19NO	beta-ketone
+CC(NC(C)(C)C)C(=O)c1ccccc1	C13H19NO	beta-ketone
+NC1CC1c1ccccc1	C9H11N	unknown
+CNC(C)(C)Cc1ccccc1	C11H17N	unknown
+CC(C)(N)Cc1ccccc1	C10H15N	unknown
+CC(c1ccccc1)C(C)(C)N	C11H17N	unknown
+NCCc1ccccc1Cl	C8H10ClN	unknown
+CC(N)Cc1ccccc1Cl	C9H12ClN	unknown
+CNC(C)Cc1ccccc1Cl	C10H14ClN	unknown
+CC(C)(N)Cc1ccccc1Cl	C10H14ClN	unknown
+NCCc1ccccc1Br	C8H10BrN	unknown
+CC(N)Cc1ccccc1Br	C9H12BrN	unknown
+NCC(O)c1ccccc1N	C8H12N2O	unknown
+NCC(=O)c1ccccc1N	C8H10N2O	beta-ketone
+Cc1ccccc1CCN	C9H13N	unknown
+CC(N)Cc1ccccc1C(F)(F)F	C10H12F3N	unknown
+NCCc1ccccc1O	C8H11NO	unknown
+CNCCc1ccccc1O	C9H13NO	unknown
+CN(C)CCc1ccccc1O	C10H15NO	unknown
+NCC(O)c1ccccc1O	C8H11NO2	unknown
+CC(N)Cc1ccccc1O	C9H13NO	unknown
+CNC(C)Cc1ccccc1O	C10H15NO	unknown
+CNCCc1ccccc1OC	C10H15NO	unknown
+COc1ccccc1CCN(C)C	C11H17NO	unknown
+COc1ccccc1C(C)CN	C10H15NO	unknown
+CNCC(C)c1ccccc1OC	C11H17NO	unknown
+CNC(C)C(C)c1ccccc1OC	C12H19NO	unknown
+CNC(C)C(=O)c1ccccc1OC	C11H15NO2	beta-ketone
+CCNC(C)Cc1ccccc1OC	C12H19NO	unknown
+CCN(CC)C(C)Cc1ccccc1OC	C14H23NO	unknown
+COc1ccccc1CC(C)NC(C)C	C13H21NO	unknown
+CCCCNC(C)Cc1ccccc1OC	C14H23NO	unknown
+COc1ccccc1CC(C)NCC(C)C	C14H23NO	unknown
+CCCCCCNC(C)Cc1ccccc1OC	C16H27NO	unknown
+COc1ccccc1CC(C)NCc1ccco1	C15H19NO2	unknown
+COc1ccccc1CC(C)N1CCOCC1	C14H21NO2	unknown
+COc1ccccc1CC(C)N1CCCCC1	C15H23NO	unknown
+CCC(N)Cc1ccccc1OC	C11H17NO	unknown
+CCOc1ccccc1CCNC	C11H17NO	unknown
+CCOc1ccccc1CCN(C)C	C12H19NO	unknown
+CCOc1ccccc1CC(C)N	C11H17NO	unknown
+CSc1ccccc1CCN	C9H13NS	unknown
+CSc1ccccc1CC(C)N	C10H15NS	unknown
+CCNC(C)Cc1cccc(F)c1	C11H16FN	unknown
+NCCc1cccc(Cl)c1	C8H10ClN	unknown
+CC(N)Cc1cccc(Cl)c1	C9H12ClN	unknown
+CCNC(C)Cc1cccc(Cl)c1	C11H16ClN	unknown
+CCNC(C)Cc1cccc(Br)c1	C11H16BrN	unknown
+CNC(C)C(=O)c1cccc(Br)c1	C10H12BrNO	beta-ketone
+CCNC(C)Cc1cccc(I)c1	C11H16IN	unknown
+CCNC(C)Cc1cccc([N+](=O)[O-])c1	C11H16N2O2	unknown
+NCCc1cccc(C(F)(F)F)c1	C9H10F3N	unknown
+CNCCc1cccc(C(F)(F)F)c1	C10H12F3N	unknown
+CCNCCc1cccc(C(F)(F)F)c1	C11H14F3N	unknown
+CN(C)CC(=O)c1cccc(C(F)(F)F)c1	C11H12F3NO	beta-ketone
+Cc1cccc(CCN)c1	C9H13N	unknown
+NCCc1cccc(O)c1	C8H11NO	unknown
+CNCCc1cccc(O)c1	C9H13NO	unknown
+CN(C)CCc1cccc(O)c1	C10H15NO	unknown
+C[N+](C)(C)CCc1cccc(O)c1	C11H17NO	unknown
+NCC(O)c1cccc(O)c1	C8H11NO2	unknown
+CNCC(O)c1cccc(O)c1	C9H13NO2	unknown
+CCNC(C)Cc1cccc(O)c1	C11H17NO	unknown
+CNCCc1cccc(OC)c1	C10H15NO	unknown
+COc1cccc(CCN(C)C)c1	C11H17NO	unknown
+CCNCCc1cccc(OC)c1	C11H17NO	unknown
+CCN(CC)CCc1cccc(OC)c1	C13H21NO	unknown
+COc1cccc(C(C)CN)c1	C10H15NO	unknown
+COc1cccc(C(C)CN(C)C)c1	C12H19NO	unknown
+COc1cccc(C(CN)OC)c1	C10H15NO2	unknown
+CNCC(OC)c1cccc(OC)c1	C11H17NO2	unknown
+COc1cccc(C(CN(C)C)OC)c1	C12H19NO2	unknown
+CCOC(CN)c1cccc(OC)c1	C11H17NO2	unknown
+COc1cccc(C(CNC(C)C)OC)c1	C13H21NO2	unknown
+CCCCNCC(OC)c1cccc(OC)c1	C14H23NO2	unknown
+COc1cccc(C(OC)C(C)N)c1	C11H17NO2	unknown
+CCOC(c1cccc(OC)c1)C(C)N	C12H19NO2	unknown
+CNC(C)C(C)c1cccc(OC)c1	C12H19NO	unknown
+CNC(C)C(=O)c1cccc(OC)c1	C11H15NO2	beta-ketone
+COc1cccc(CC(C)N(C)C)c1	C12H19NO	unknown
+CCNC(C)Cc1cccc(OC)c1	C12H19NO	unknown
+CCN(CC)C(C)Cc1cccc(OC)c1	C14H23NO	unknown
+CCCCNC(C)Cc1cccc(OC)c1	C14H23NO	unknown
+CCC(N)Cc1cccc(OC)c1	C11H17NO	unknown
+CCOc1cccc(CCNC)c1	C11H17NO	unknown
+CCOc1cccc(CC(C)NC)c1	C12H19NO	unknown
+CCOc1cccc(CCN(C)C)c1	C12H19NO	unknown
+CCOc1cccc(C(CN)OC)c1	C11H17NO2	unknown
+CCOc1cccc(C(CN)OCC)c1	C12H19NO2	unknown
+CCOc1cccc(CC(C)N)c1	C11H17NO	unknown
+CCCOc1cccc(C(CN)OC)c1	C12H19NO2	unknown
+C=CCOc1cccc(C(CN)OC)c1	C12H17NO2	unknown
+CSc1cccc(CC(C)N)c1	C10H15NS	unknown
+NCCc1ccc(F)cc1	C8H10FN	unknown
+CC(C)NCCc1ccc(Cl)cc1	C11H16ClN	unknown
+CC(CN)c1ccc(Cl)cc1	C9H12ClN	unknown
+CC(N)C(F)(F)c1ccc(Cl)cc1	C9H10ClF2N	unknown
+CCNCCc1ccc(Cl)cc1	C10H14ClN	unknown
+CC(C)NC(C)Cc1ccc(Cl)cc1	C12H18ClN	unknown
+CC(C)(N)Cc1ccc(Cl)cc1	C10H14ClN	unknown
+CCCN(CC)CCc1c[nH]c2cccc(O)c12	C15H22N2O	tryptamine
+NCCc1ccc(Br)cc1	C8H10BrN	unknown
+NC1CC1c1ccc(Br)cc1	C9H10BrN	unknown
+NCCc1ccc(I)cc1	C8H10IN	unknown
+NCCc1ccc(N)cc1	C8H12N2	unknown
+CC(N)Cc1ccc(N)cc1	C9H14N2	unknown
+CNC(C)Cc1ccc(N)cc1	C10H16N2	unknown
+CNc1ccc(CC(C)NC)cc1	C11H18N2	unknown
+CN(C)c1ccc(CCN)cc1	C10H16N2	unknown
+CNC(C)Cc1ccc(N(C)C)cc1	C12H20N2	unknown
+CC(N)Cc1ccc([N+](=O)[O-])cc1	C9H12N2O2	unknown
+CNC(C)Cc1ccc([N+](=O)[O-])cc1	C10H14N2O2	unknown
+CC(N)Cc1ccc(C(F)(F)F)cc1	C10H12F3N	unknown
+Cc1ccc(CCN)cc1	C9H13N	unknown
+CNC(C)Cc1ccc(C)cc1	C11H17N	unknown
+CCc1ccc(CCN)cc1	C10H15N	unknown
+CCCc1ccc(CCN)cc1	C11H17N	unknown
+CCCc1ccc(CC(C)N)cc1	C12H19N	unknown
+CC(C)c1ccc(CCN)cc1	C11H17N	unknown
+CC(N)Cc1ccc(C(C)C)cc1	C12H19N	unknown
+CCCCc1ccc(CCN)cc1	C12H19N	unknown
+CC(C)(C)c1ccc(CCN)cc1	C12H19N	unknown
+CCCCCCc1ccc(CCN)cc1	C14H23N	unknown
+CC(CN)c1ccc(O)cc1	C9H13NO	unknown
+CN(C)CC(O)c1ccc(O)cc1	C10H15NO2	unknown
+CNCC(OC)c1ccc(O)cc1	C10H15NO2	unknown
+CNC(C)Cc1ccc(O)cc1	C10H15NO	unknown
+CCCCNC(C)Cc1ccc(O)cc1	C13H21NO	unknown
+CC(N)C(O)c1ccc(O)cc1	C9H13NO2	unknown
+CNC(C)C(O)c1ccc(O)cc1	C10H15NO2	unknown
+CC(Cc1ccc(O)cc1)N(C)C	C11H17NO	unknown
+CCNC(C)Cc1ccc(O)cc1	C11H17NO	unknown
+CCC(N)Cc1ccc(O)cc1	C10H15NO	unknown
+CNCCc1ccc(OC(C)=O)cc1	C11H15NO2	unknown
+CC(=O)Oc1ccc(CCN(C)C)cc1	C12H17NO2	unknown
+CNCCc1ccc(OC)cc1	C10H15NO	unknown
+COc1ccc(CCN(C)C)cc1	C11H17NO	unknown
+COc1ccc(C(O)CN)cc1	C9H13NO2	unknown
+COc1ccc(C(C)CN)cc1	C10H15NO	unknown
+CNCC(C)c1ccc(OC)cc1	C11H17NO	unknown
+COc1ccc(C(C)CN(C)C)cc1	C12H19NO	unknown
+CCNCC(C)c1ccc(OC)cc1	C12H19NO	unknown
+COc1ccc(C(CN)OC)cc1	C10H15NO2	unknown
+COc1ccc(CC(C)NO)cc1	C10H15NO2	unknown
+CNC(C)C(C)c1ccc(OC)cc1	C12H19NO	unknown
+CCCNC(C)Cc1ccc(OC)cc1	C13H21NO	unknown
+CCCNC(C)C(O)c1ccc(OC)cc1	C13H21NO2	unknown
+COc1ccc(CC(C)NC(C)C)cc1	C13H21NO	unknown
+COc1ccc(CC(C)(C)N)cc1	C11H17NO	unknown
+CCC(N)Cc1ccc(OC)cc1	C11H17NO	unknown
+CCOc1ccc(CCN)cc1	C10H15NO	unknown
+CCOc1ccc(CCNC)cc1	C11H17NO	unknown
+CCOc1ccc(CCN(C)C)cc1	C12H19NO	unknown
+CCOc1ccc(CC(C)NC)cc1	C12H19NO	unknown
+CCOc1ccc(CC(N)CC)cc1	C12H19NO	unknown
+CCCOc1ccc(CCN)cc1	C11H17NO	unknown
+CCCOc1ccc(CC(C)N)cc1	C12H19NO	unknown
+CCCCOc1ccc(CCN)cc1	C12H19NO	unknown
+CCCCCOc1ccc(CCN)cc1	C13H21NO	unknown
+CCCCCCOc1ccc(CCN)cc1	C14H23NO	unknown
+CCCCCCCOc1ccc(CCN)cc1	C15H25NO	unknown
+CCCCCCCCOc1ccc(CCN)cc1	C16H27NO	unknown
+CCCCCCCCCOc1ccc(CCN)cc1	C17H29NO	unknown
+CC(N)Cc1ccc(SC(C)C)cc1	C12H19NS	unknown
+CC(N)Cc1ccc(Oc2ccccc2)cc1	C15H17NO	unknown
+CC(N)Cc1ccc(OCc2ccccc2)cc1	C16H19NO	unknown
+CNC(C)Cc1ccc(SC)cc1	C11H17NS	unknown
+CSc1ccc(CC(C)N(C)C)cc1	C12H19NS	unknown
+CCNC(C)Cc1ccc(SC)cc1	C12H19NS	unknown
+CCN(CC)C(C)Cc1ccc(SC)cc1	C14H23NS	unknown
+CCCNC(C)Cc1ccc(SC)cc1	C13H21NS	unknown
+CCCN(CCC)C(C)Cc1ccc(SC)cc1	C16H27NS	unknown
+C=CCNC(C)Cc1ccc(SC)cc1	C13H19NS	unknown
+C=CCN(CC=C)C(C)Cc1ccc(SC)cc1	C16H23NS	unknown
+CCC(N)Cc1ccc(SC)cc1	C11H17NS	unknown
+CCSc1ccc(CC(C)N)cc1	C11H17NS	unknown
+Cc1cccc(CCN)c1C	C10H15N	unknown
+Cc1cccc(CC(C)N)c1C	C11H17N	unknown
+Cc1cccc(CCN)c1O	C9H13NO	unknown
+CNCCc1cccc(C)c1O	C10H15NO	unknown
+Cc1cccc(CCN(C)C)c1O	C11H17NO	unknown
+Cc1cccc(CC(C)N)c1O	C10H15NO	unknown
+CNC(C)Cc1cccc(C)c1O	C11H17NO	unknown
+Cc1cccc(CC(C)N(C)C)c1O	C12H19NO	unknown
+COc1c(C)cccc1CC(C)N	C11H17NO	unknown
+CNC(C)Cc1cccc(C)c1OC	C12H19NO	unknown
+COc1c(C)cccc1CC(C)N(C)C	C13H21NO	unknown
+CCCN(CCC)C1CCc2c(O)cccc2C1	C16H25NO	unknown
+NCCc1cccc(O)c1O	C8H11NO2	unknown
+CN(C)CCc1cccc(O)c1O	C10H15NO2	unknown
+COc1cccc(C(CN)OC)c1Cl	C10H14ClNO2	unknown
+COc1cccc(CCN)c1O	C9H13NO2	unknown
+CNCCc1cccc(OC)c1OC	C11H17NO2	unknown
+COc1cccc(CCN(C)C)c1OC	C12H19NO2	unknown
+CNC(C)Cc1cccc(OC)c1OC	C12H19NO2	unknown
+CCC(Cc1cccc(OC)c1OC)NC	C13H21NO2	unknown
+CCOc1c(CCN)cccc1OC	C11H17NO2	unknown
+CCOc1c(CCNC)cccc1OC	C12H19NO2	unknown
+CCOc1c(CCN(C)C)cccc1OC	C13H21NO2	unknown
+NCCc1cccc2c1OCO2	C9H11NO2	unknown
+CNCCc1cccc2c1OCO2	C10H13NO2	unknown
+CN(C)CCc1cccc2c1OCO2	C11H15NO2	unknown
+CCNCCc1cccc2c1OCO2	C11H15NO2	unknown
+CNC(C)Cc1cccc2c1OCO2	C11H15NO2	unknown
+CC(Cc1cccc2c1OCO2)N(C)C	C12H17NO2	unknown
+CCNC(C)Cc1cccc2c1OCO2	C12H17NO2	unknown
+CC(C)(N)Cc1cccc2c1OCO2	C11H15NO2	unknown
+CCC(N)Cc1cccc2c1OCO2	C11H15NO2	unknown
+CCC(Cc1cccc2c1OCO2)NC	C12H17NO2	unknown
+CCC(Cc1cccc2c1OCO2)N(C)C	C13H19NO2	unknown
+CCNC(CC)Cc1cccc2c1OCO2	C13H19NO2	unknown
+NC1Cc2ccc([N+](=O)[O-])cc2C1	C9H10N2O2	unknown
+Cc1cc(N(C)C)ccc1CC(C)N	C12H20N2	unknown
+CC(N)Cc1ccc(F)cc1F	C9H11F2N	unknown
+NC1Cc2ccc(F)cc2C1	C9H10FN	unknown
+NC1Cc2ccc(Cl)cc2C1	C9H10ClN	unknown
+CN(C)C1Cc2ccc(Cl)cc2C1	C11H14ClN	unknown
+COc1cc(Br)ccc1CCN	C9H12BrNO	unknown
+COc1cc(Br)ccc1CC(C)N	C10H14BrNO	unknown
+NC1Cc2ccc(Br)cc2C1	C9H10BrN	unknown
+COc1cc(I)ccc1CC(C)N	C10H14INO	unknown
+COc1cc(C(F)(F)F)ccc1CC(C)N	C11H14F3NO	unknown
+Cc1ccc(CCN)c(C)c1	C10H15N	unknown
+Cc1ccc(CC(C)N)c(C)c1	C11H17N	unknown
+COc1cc(C)ccc1CCN	C10H15NO	unknown
+CNC(C)Cc1ccc(C)cc1OC	C12H19NO	unknown
+NCCc1ccc([N+](=O)[O-])cc1O	C8H10N2O3	unknown
+CCCN(CCC)C1CCc2cc(O)ccc2C1	C16H25NO	unknown
+NCCc1ccc(O)cc1O	C8H11NO2	unknown
+COc1cc(O)ccc1CCN	C9H13NO2	unknown
+COc1cc(O)ccc1C(C)CN	C10H15NO2	unknown
+COc1ccc(CC(C)N)c(O)c1	C10H15NO2	unknown
+CNCCc1ccc(OC)cc1OC	C11H17NO2	unknown
+COc1ccc(C(=O)C(C)N)c(OC)c1	C11H15NO3	beta-ketone
+CCC(N)Cc1ccc(OC)cc1OC	C12H19NO2	unknown
+CCOc1cc(OC)ccc1CCN	C11H17NO2	unknown
+CSc1ccc2c(c1)CC(N)C2	C10H13NS	unknown
+CCOc1ccc(CCN)c(OCC)c1	C12H19NO2	unknown
+CC(N)Cc1ccc(F)c(F)c1	C9H11F2N	unknown
+NCCc1ccc(Cl)c(Cl)c1	C8H9Cl2N	unknown
+CC(N)Cc1ccc(Cl)c(Cl)c1	C9H11Cl2N	unknown
+CNC(C)Cc1ccc(Cl)c(Cl)c1	C10H13Cl2N	unknown
+COc1cc(CC(C)N)ccc1C(F)(F)F	C11H14F3NO	unknown
+CC(N)Cc1ccc2c(c1)COC2	C11H15NO	unknown
+CNC(C)Cc1ccc2c(c1)COC2	C12H17NO	unknown
+Cc1ccc(C(O)CN)cc1C	C10H15NO	unknown
+CNCC(O)c1ccc(C)c(C)c1	C11H17NO	unknown
+CNC(C)Cc1ccc(C)c(C)c1	C12H19N	unknown
+COC(c1ccc2c(c1)OCO2)C(C)NC(N)=O	C12H16N2O4	unknown
+COc1cc(CC(N)OC(C)=O)c(OC)cc1C	C13H19NO4	unknown
+CNC(C)Cc1ccc(C)c(OC)c1	C12H19NO	unknown
+CC(N)Cc1ccc(O)c(Br)c1	C9H12BrNO	unknown
+NCCc1ccc(O)c(Cl)c1	C8H10ClNO	unknown
+CC(N)Cc1ccc(O)c(Cl)c1	C9H12ClNO	unknown
+NCCc1ccc(O)c([N+](=O)[O-])c1	C8H10N2O3	unknown
+CC(C)N(C)CCc1ccc(O)c(O)c1	C12H19NO2	unknown
+CN(C)CCc1ccc(O)c(O)c1	C10H15NO2	unknown
+C[N+](C)(C)CCc1ccc(O)c(O)c1	C11H17NO2	unknown
+CCNCCc1ccc(O)c(O)c1	C10H15NO2	unknown
+CCCCNCCc1ccc(O)c(O)c1	C12H19NO2	unknown
+CC(C)CNCCc1ccc(O)c(O)c1	C12H19NO2	unknown
+CC(CN)c1ccc(O)c(O)c1	C9H13NO2	unknown
+CN(C)CC(O)c1ccc(O)c(O)c1	C10H15NO3	unknown
+CCNCC(O)c1ccc(O)c(O)c1	C10H15NO3	unknown
+CC(C)NCC(O)c1ccc(O)c(O)c1	C11H17NO3	unknown
+NCC(=O)c1ccc(O)c(O)c1	C8H9NO3	beta-ketone
+CNCC(=O)c1ccc(O)c(O)c1	C9H11NO3	beta-ketone
+CC(C)NCC(=O)c1ccc(O)c(O)c1	C11H15NO3	beta-ketone
+CC(Cc1ccc(O)c(O)c1)NO	C9H13NO3	unknown
+CNC(C)Cc1ccc(O)c(O)c1	C10H15NO2	unknown
+CC(Cc1ccc(O)c(O)c1)N(C)O	C10H15NO3	unknown
+CC(Cc1ccc(O)c(O)c1)N(C)C	C11H17NO2	unknown
+CC(N)C(O)c1ccc(O)c(O)c1	C9H13NO3	unknown
+CNC(C)C(O)c1ccc(O)c(O)c1	C10H15NO3	unknown
+CC(C)NC(C)C(=O)c1ccc(O)c(O)c1	C12H17NO3	beta-ketone
+CCNC(C)Cc1ccc(O)c(O)c1	C11H17NO2	unknown
+CCC(N)Cc1ccc(O)c(O)c1	C10H15NO2	unknown
+CCC(N)C(O)c1ccc(O)c(O)c1	C10H15NO3	unknown
+COc1cc(C(C)CN)ccc1O	C10H15NO2	unknown
+COc1cc(C(O)CN)ccc1O	C9H13NO3	unknown
+CNCC(O)c1ccc(O)c(OC)c1	C10H15NO3	unknown
+COc1cc(C(O)CNC(C)C)ccc1O	C12H19NO3	unknown
+COc1cc(C(=O)CN)ccc1O	C9H11NO3	beta-ketone
+CNCC(=O)c1ccc(O)c(OC)c1	C10H13NO3	beta-ketone
+COc1cc(CC(C)NO)ccc1O	C10H15NO3	unknown
+CNC(C)Cc1ccc(O)c(OC)c1	C11H17NO2	unknown
+COc1cc(CC(C)N(C)O)ccc1O	C11H17NO3	unknown
+CCNC(C)Cc1ccc(O)c(OC)c1	C12H19NO2	unknown
+CNC(C)C(=O)c1ccc(O)c(OC)c1	C11H15NO3	beta-ketone
+CCC(N)Cc1ccc(O)c(OC)c1	C11H17NO2	unknown
+CCC(Cc1ccc(O)c(OC)c1)NC	C12H19NO2	unknown
+CNCCc1ccc(OC(C)=O)c(OC(C)=O)c1	C13H17NO4	unknown
+CC(=O)Oc1ccc(CCN(C)C)cc1OC(C)=O	C14H19NO4	unknown
+CC(=O)Oc1ccc(CC(C)N(C)C)cc1OC(C)=O	C15H21NO4	unknown
+CNCCc1ccc(OC)c(Cl)c1	C10H14ClNO	unknown
+COc1ccc(CC(C)N)cc1I	C10H14INO	unknown
+CNC(C)Cc1ccc(OC)c(C)c1	C12H19NO	unknown
+COc1ccc(CC(C)(C)N)cc1C	C12H19NO	unknown
+CCC(N)Cc1ccc(OC)c(C)c1	C12H19NO	unknown
+COc1ccc(CCN)cc1O	C9H13NO2	unknown
+CNCCc1ccc(OC)c(O)c1	C10H15NO2	unknown
+COc1ccc(CC[N+](C)(C)C)cc1O	C12H19NO2	unknown
+COc1ccc(C(O)CN)cc1O	C9H13NO3	unknown
+CNCC(O)c1ccc(OC)c(O)c1	C10H15NO3	unknown
+COc1ccc(C(O)CN(C)C)cc1O	C11H17NO3	unknown
+COc1ccc(C(=O)CN)cc1O	C9H11NO3	beta-ketone
+CNCC(=O)c1ccc(OC)c(O)c1	C10H13NO3	beta-ketone
+CNC(C)C(=O)c1ccc(OC)c(O)c1	C11H15NO3	beta-ketone
+COc1ccc(CC(C)N)cc1O	C10H15NO2	unknown
+CNC(C)Cc1ccc(OC)c(O)c1	C11H17NO2	unknown
+CCNC(C)Cc1ccc(OC)c(O)c1	C12H19NO2	unknown
+COc1ccc(C(C)CN)cc1OC	C11H17NO2	unknown
+CNCC(O)c1ccc(OC)c(OC)c1	C11H17NO3	unknown
+COc1ccc(C(O)CN(C)C=O)cc1OC	C12H17NO4	unknown
+COc1ccc(C(CN)OC)cc1OC	C11H17NO3	unknown
+CNCC(OC)c1ccc(OC)c(OC)c1	C12H19NO3	unknown
+COc1ccc(C(CN(C)C)OC)cc1OC	C13H21NO3	unknown
+CNCCc1ccc(OC)c(OC)c1	C11H17NO2	unknown
+COc1ccc(CCN(C)C)cc1OC	C12H19NO2	unknown
+CCNCCc1ccc(OC)c(OC)c1	C12H19NO2	unknown
+COc1ccc(C2CC2N)cc1OC	C11H15NO2	unknown
+COc1ccc(CC(C)NO)cc1OC	C11H17NO3	unknown
+CNC(C)Cc1ccc(OC)c(OC)c1	C12H19NO2	unknown
+COc1ccc(CC(C)N(C)C)cc1OC	C13H21NO2	unknown
+CCNC(C)Cc1ccc(OC)c(OC)c1	C13H21NO2	unknown
+CCCNC(C)Cc1ccc(OC)c(OC)c1	C14H23NO2	unknown
+COc1ccc(CC(C)NCc2ccccc2)cc1OC	C18H23NO2	unknown
+COc1ccc(CC(C)N(C)O)cc1OC	C12H19NO3	unknown
+COc1ccc(C(O)C(C)N)cc1OC	C11H17NO3	unknown
+CCOc1cc(CCN)ccc1OC	C11H17NO2	unknown
+CCOc1cc(CCNC)ccc1OC	C12H19NO2	unknown
+CCOc1cc(CCN(C)C)ccc1OC	C13H21NO2	unknown
+CCOc1cc(CC(C)N)ccc1OC	C12H19NO2	unknown
+CCOc1ccc(CCN(C)C)cc1OC	C13H21NO2	unknown
+CCOc1ccc(C(O)CN)cc1OC	C11H17NO3	unknown
+CCOc1ccc(CC(C)N)cc1OC	C12H19NO2	unknown
+CCOc1ccc(CCN)cc1OCC	C12H19NO2	unknown
+CCOc1ccc(CCNC)cc1OCC	C13H21NO2	unknown
+CCOc1ccc(CCN(C)C)cc1OCC	C14H23NO2	unknown
+CCOc1ccc(C(O)CN)cc1OCC	C12H19NO3	unknown
+CCOc1ccc(CC(C)N)cc1OCC	C13H21NO2	unknown
+C=CCOc1ccc(CCN)cc1OC	C12H17NO2	unknown
+CSc1ccc(CC(C)N)cc1C	C11H17NS	unknown
+CCN(C)CCc1ccc2c(c1)OCO2	C12H17NO2	unknown
+CCNCCc1ccc2c(c1)OCO2	C11H15NO2	unknown
+CCCNCCc1ccc2c(c1)OCO2	C12H17NO2	unknown
+CC(C)NCCc1ccc2c(c1)OCO2	C12H17NO2	unknown
+CC(CN)c1ccc2c(c1)OCO2	C10H13NO2	unknown
+CNCC(C)c1ccc2c(c1)OCO2	C11H15NO2	unknown
+CCN(C)C(C)Cc1ccc2c(c1)OCO2	C13H19NO2	unknown
+CCCN(C)C(C)Cc1ccc2c(c1)OCO2	C14H21NO2	unknown
+CC(C)N(C)C(C)Cc1ccc2c(c1)OCO2	C14H21NO2	unknown
+CCC(C)NC(C)Cc1ccc2c(c1)OCO2	C14H21NO2	unknown
+CC(N)C(O)c1ccc2c(c1)OCO2	C10H13NO3	unknown
+CCCNC(C)C(=O)c1ccc2c(c1)OCO2	C13H17NO3	beta-ketone
+CC(C)NC(C)C(=O)c1ccc2c(c1)OCO2	C13H17NO3	beta-ketone
+CC(NC1CC1)C(=O)c1ccc2c(c1)OCO2	C13H15NO3	beta-ketone
+C=CCNC(C)C(=O)c1ccc2c(c1)OCO2	C13H15NO3	beta-ketone
+C#CCNC(C)C(=O)c1ccc2c(c1)OCO2	C13H13NO3	beta-ketone
+CCCCNC(C)C(=O)c1ccc2c(c1)OCO2	C14H19NO3	beta-ketone
+CC(C)CNC(C)C(=O)c1ccc2c(c1)OCO2	C14H19NO3	beta-ketone
+CCC(C)NC(C)C(=O)c1ccc2c(c1)OCO2	C14H19NO3	beta-ketone
+CC(NC(C)(C)C)C(=O)c1ccc2c(c1)OCO2	C14H19NO3	beta-ketone
+NC1CC1c1ccc2c(c1)OCO2	C10H11NO2	unknown
+CCC(C)(N)Cc1ccc2c(c1)OCO2	C12H17NO2	unknown
+CCC(Cc1ccc2c(c1)OCO2)N(C)C	C13H19NO2	unknown
+CCC(C(=O)c1ccc2c(c1)OCO2)N(CC)CC	C15H21NO3	beta-ketone
+CCCNC(CC)Cc1ccc2c(c1)OCO2	C14H21NO2	unknown
+CCCNC(CC)C(=O)c1ccc2c(c1)OCO2	C14H19NO3	beta-ketone
+CCC(Cc1ccc2c(c1)OCO2)NC(C)C	C14H21NO2	unknown
+CCC(NC(C)C)C(=O)c1ccc2c(c1)OCO2	C14H19NO3	beta-ketone
+CCC(Cc1ccc2c(c1)OCO2)NO	C11H15NO3	unknown
+CCCC(C(=O)c1ccc2c(c1)OCO2)N(C)C	C14H19NO3	beta-ketone
+CCCC(NCC)C(=O)c1ccc2c(c1)OCO2	C14H19NO3	beta-ketone
+CCCC(C(=O)c1ccc2c(c1)OCO2)N(CC)CC	C16H23NO3	beta-ketone
+CCCNC(CCC)C(=O)c1ccc2c(c1)OCO2	C15H21NO3	beta-ketone
+CCCC(NC(C)C)C(=O)c1ccc2c(c1)OCO2	C15H21NO3	beta-ketone
+CCCCNC(CCC)C(=O)c1ccc2c(c1)OCO2	C16H23NO3	beta-ketone
+CCCC(NC(C)CC)C(=O)c1ccc2c(c1)OCO2	C16H23NO3	beta-ketone
+CC(C)C(N)Cc1ccc2c(c1)OCO2	C12H17NO2	unknown
+CCCCC(C(=O)c1ccc2c(c1)OCO2)N(C)C	C15H21NO3	beta-ketone
+CCCCC(C(=O)c1ccc2c(c1)OCO2)N(CC)CC	C17H25NO3	beta-ketone
+NCCc1ccc2c(c1)OCCO2	C10H13NO2	unknown
+CN(C)CCc1ccc2c(c1)OCCO2	C12H17NO2	unknown
+c1cc2c(cc1CCN1CCCC1)OCCO2	C14H19NO2	unknown
+c1cc2c(cc1CCN1CCOCC1)OCCO2	C14H19NO3	unknown
+CC(N)Cc1ccc2c(c1)OCCO2	C11H15NO2	unknown
+CC(Cc1ccc2c(c1)OCCO2)N(C)C	C13H19NO2	unknown
+CCNC(C)Cc1ccc2c(c1)OCCO2	C13H19NO2	unknown
+CC(Cc1ccc2c(c1)OCCO2)N1CCCC1	C15H21NO2	unknown
+CC(Cc1ccc2c(c1)OCCO2)N1CCOCC1	C15H21NO3	unknown
+CC(N)Cc1cc(F)ccc1F	C9H11F2N	unknown
+COc1ccc(I)cc1CC(C)N	C10H14INO	unknown
+Cc1ccc(C)c(CCN)c1	C10H15N	unknown
+CNC(C)Cc1cc(C)ccc1C	C12H19N	unknown
+Cc1ccc(O)c(C(O)CN)c1	C9H13NO2	unknown
+CNCC(O)c1cc(C)ccc1O	C10H15NO2	unknown
+Cc1ccc(O)c(C(=O)CN)c1	C9H11NO2	beta-ketone
+CNCC(=O)c1cc(C)ccc1O	C10H13NO2	beta-ketone
+Cc1ccc(O)c(C(O)C(C)N)c1	C10H15NO2	unknown
+CNC(C)C(O)c1cc(C)ccc1O	C11H17NO2	unknown
+COc1ccc(C)cc1C(O)CN	C10H15NO2	unknown
+CNCC(O)c1cc(C)ccc1OC	C11H17NO2	unknown
+COc1ccc(C)cc1C(O)C(C)N	C11H17NO2	unknown
+CNC(C)C(O)c1cc(C)ccc1OC	C12H19NO2	unknown
+COc1ccc(C)cc1C(=O)CN	C10H13NO2	beta-ketone
+CCCN(CCC)C1CCc2ccc(O)cc2C1	C16H25NO	unknown
+CNCC(O)c1cc(O)ccc1OC	C10H15NO3	unknown
+CNCC(=O)c1cc(O)ccc1OC	C10H13NO3	beta-ketone
+COc1ccc(I)c(CC(C)N)c1	C10H14INO	unknown
+COc1ccc(O)c(CCN)c1	C9H13NO2	unknown
+COc1ccc(O)c(CCN(C)C)c1	C11H17NO2	unknown
+COc1ccc(O)c(C(O)CN)c1	C9H13NO3	unknown
+CNCC(O)c1cc(OC)ccc1O	C10H15NO3	unknown
+COc1ccc(O)c(C(=O)CN)c1	C9H11NO3	beta-ketone
+COc1ccc(O)c(CC(C)N)c1	C10H15NO2	unknown
+COc1ccc(O)c(CC(C)N(C)C)c1	C12H19NO2	unknown
+COc1ccc(O)c(C(O)C(C)N)c1	C10H15NO3	unknown
+CNC(C)C(O)c1cc(OC)ccc1O	C11H17NO3	unknown
+COc1ccc(OC)c(CCN(C)C)c1	C12H19NO2	unknown
+COc1ccc(OC)c(C(C)CN)c1	C11H17NO2	unknown
+CNCC(C)c1cc(OC)ccc1OC	C12H19NO2	unknown
+COc1ccc(OC)c(C(C)CN(C)C)c1	C13H21NO2	unknown
+COc1ccc(OC)c(C(O)CN)c1	C10H15NO3	unknown
+COc1ccc(OC)c(C(=O)CN)c1	C10H13NO3	beta-ketone
+CNCC(O)c1cc(OC)ccc1OC	C11H17NO3	unknown
+COc1ccc(OC)c(C(O)CN(C)C)c1	C12H19NO3	unknown
+COc1ccc(OC)c(C(CN)OC)c1	C11H17NO3	unknown
+COc1ccc(OC)c(C(C)(O)CN)c1	C11H17NO3	unknown
+CNCC(C)(O)c1cc(OC)ccc1OC	C12H19NO3	unknown
+COc1ccc(OC)c(C(C)(O)CN(C)C)c1	C13H21NO3	unknown
+COc1ccc(OC)c(C(=O)CN(C)C)c1	C12H17NO3	beta-ketone
+CC(=O)O[C@H]1CC[C@@]2(C)C(=CC[C@@H]3[C@@H]2CC[C@]2(C)C(=O)CC[C@@H]32)C1	C21H30O3	unknown
+CNC(C)C(O)c1cc(OC)ccc1OC	C12H19NO3	unknown
+COc1ccc(OC)c(C(O)C(C)N(C)C)c1	C13H21NO3	unknown
+COc1ccc(OC)c(C(O)C(C)NC(C)C)c1	C14H23NO3	unknown
+CNC(C)C(=O)c1cc(OC)ccc1OC	C12H17NO3	beta-ketone
+CCOc1ccc(O)c(C(O)CN)c1	C10H15NO3	unknown
+CCOc1ccc(O)c(C(O)CNC)c1	C11H17NO3	unknown
+CCOc1ccc(O)c(C(=O)CN)c1	C10H13NO3	beta-ketone
+CCOc1ccc(O)c(C(=O)CNC)c1	C11H15NO3	beta-ketone
+CCOc1ccc(O)c(C(O)C(C)N)c1	C11H17NO3	unknown
+CCOc1ccc(O)c(C(O)C(C)NC)c1	C12H19NO3	unknown
+CCOc1ccc(O)c(C(=O)C(C)NC)c1	C12H17NO3	beta-ketone
+CCOc1ccc(OCC)c(C(O)CN)c1	C12H19NO3	unknown
+CCOc1ccc(OCC)c(C(O)CNC)c1	C13H21NO3	unknown
+CCOc1ccc(OCC)c(C(=O)CNC)c1	C13H19NO3	beta-ketone
+CCOc1ccc(OCC)c(C(O)C(C)N)c1	C13H21NO3	unknown
+CCOc1ccc(OCC)c(C(O)C(C)NC)c1	C14H23NO3	unknown
+CCOc1ccc(OCC)c(C(=O)C(C)N)c1	C13H19NO3	beta-ketone
+Cc1cc(C)cc(CCN)c1	C10H15N	unknown
+Cc1cc(C)cc(CC(C)N)c1	C11H17N	unknown
+NCCc1cc(O)cc(O)c1	C8H11NO2	unknown
+COc1cc(O)cc(CCN)c1	C9H13NO2	unknown
+CNCCc1cc(OC)cc(OC)c1	C11H17NO2	unknown
+COc1cc(CCN(C)C)cc(OC)c1	C12H19NO2	unknown
+COc1cc(OC)cc(C(O)CN)c1	C10H15NO3	unknown
+CNCC(O)c1cc(OC)cc(OC)c1	C11H17NO3	unknown
+COc1cc(OC)cc(C(O)CN(C)C)c1	C12H19NO3	unknown
+CNC(C)Cc1cc(OC)cc(OC)c1	C12H19NO2	unknown
+CCC(N)Cc1cc(C)cc(C)c1	C12H19N	unknown
+CC(N)Cc1c(Cl)cccc1Cl	C9H11Cl2N	unknown
+Cc1cccc(C)c1CCN	C10H15N	unknown
+NC1CCc2cccc(O)c2C1	C10H13NO	unknown
+CNC1CCc2cccc(O)c2C1	C11H15NO	unknown
+CN(C)C1CCc2cccc(O)c2C1	C12H17NO	unknown
+CCNC1CCc2cccc(O)c2C1	C12H17NO	unknown
+CCN(CC)C1CCc2cccc(O)c2C1	C14H21NO	unknown
+CCCNC1CCc2cccc(O)c2C1	C13H19NO	unknown
+CCCN(CC)C1CCc2cccc(O)c2C1	C15H23NO	unknown
+CC(C)NC1CCc2cccc(O)c2C1	C13H19NO	unknown
+CCCCNC1CCc2cccc(O)c2C1	C14H21NO	unknown
+CCCCN(CCCC)C1CCc2cccc(O)c2C1	C18H29NO	unknown
+NCCc1c(O)cccc1O	C8H11NO2	unknown
+COc1cccc(Br)c1CC(C)N	C10H14BrNO	unknown
+COc1cccc(O)c1CCN	C9H13NO2	unknown
+CNCCc1c(OC)cccc1OC	C11H17NO2	unknown
+COc1cccc(OC)c1CCN(C)C	C12H19NO2	unknown
+COc1cccc(OC)c1C(O)CN	C10H15NO3	unknown
+CNCC(O)c1c(OC)cccc1OC	C11H17NO3	unknown
+CNC(C)Cc1c(OC)cccc1OC	C12H19NO2	unknown
+COc1c(Br)ccc(CCN)c1OC	C10H14BrNO2	unknown
+COc1c(Br)ccc(CC(C)N)c1OC	C11H16BrNO2	unknown
+Cc1ccc(CCN)c(C)c1C	C11H17N	unknown
+Cc1ccc(CC(C)N)c(C)c1C	C12H19N	unknown
+COc1c(C)ccc(CC(C)N)c1OC	C12H19NO2	unknown
+CCc1ccc(CC(C)N)c(OC)c1OC	C13H21NO2	unknown
+COc1ccc(CCN)c(OC)c1Br	C10H14BrNO2	unknown
+COc1ccc(CC(C)N)c(OC)c1Br	C11H16BrNO2	unknown
+COc1ccc(CC(C)N)c(OC)c1C	C12H19NO2	unknown
+CCc1c(OC)ccc(CC(C)N)c1OC	C13H21NO2	unknown
+CCCSc1c(OC)ccc(CCN)c1OC	C13H21NO2S	unknown
+COc1ccc(CCN)c(Cl)c1OC	C10H14ClNO2	unknown
+COc1ccc(CCN)c(Br)c1OC	C10H14BrNO2	unknown
+COc1ccc(CC(C)N)c(Br)c1OC	C11H16BrNO2	unknown
+COc1ccc(CC(C)N)c(C)c1OC	C12H19NO2	unknown
+CCc1c(CC(C)N)ccc(OC)c1OC	C13H21NO2	unknown
+CNC(C)Cc1ccc(OC)c(OC)c1OC	C13H21NO3	unknown
+CCC(N)Cc1ccc(OC)c(OC)c1OC	C13H21NO3	unknown
+COc1ccc(CCN)c2c1OCO2	C10H13NO3	unknown
+CCCSc1c(CCN)ccc(OC)c1OC	C13H21NO2S	unknown
+CCOc1ccc(CCN)c(OCC)c1OCC	C14H23NO3	unknown
+CNC1Cc2ccc3c(c2C1)OCO3	C11H13NO2	unknown
+CNC(C)Cc1ccc2c(c1O)OCO2	C11H15NO3	unknown
+COc1c(CCN)ccc2c1OCO2	C10H13NO3	unknown
+CNCCc1ccc2c(c1OC)OCO2	C11H15NO3	unknown
+CCC(N)Cc1ccc2c(c1OC)OCO2	C12H17NO3	unknown
+CCCSc1ccc(CCN)c(OC)c1OC	C13H21NO2S	unknown
+COc1cc(Br)cc(CCN)c1OC	C10H14BrNO2	unknown
+Cc1cc(C)c(C)c(CCN)c1	C11H17N	unknown
+Cc1cc(C)c(C)c(CC(C)N)c1	C12H19N	unknown
+COc1cc(C)cc(CC(C)N)c1OC	C12H19NO2	unknown
+CCc1cc(CC(C)N)c(OC)c(OC)c1	C13H21NO2	unknown
+Cc1cc(Br)c(C)c(CCN)c1	C10H14BrN	unknown
+COc1cc(Br)c(OC)c(CC(C)N)c1	C11H16BrNO2	unknown
+COc1cc(CC(C)N)c(OC)c([N+](=O)[O-])c1	C11H16N2O4	unknown
+COc1cc(C)c(OC)c(CC(C)N)c1	C12H19NO2	unknown
+CCc1cc(OC)cc(CC(C)N)c1OC	C13H21NO2	unknown
+CCCSc1cc(OC)cc(CCN)c1OC	C13H21NO2S	unknown
+Cc1cc(C)c(Br)c(CCN)c1	C10H14BrN	unknown
+COc1cc(CC(C)N)c(I)c(OC)c1	C11H16INO2	unknown
+COc1cc(CC(C)N)c(C)c(OC)c1	C12H19NO2	unknown
+CCc1c(CC(C)N)cc(OC)cc1OC	C13H21NO2	unknown
+COc1cc(CCN)c(OC)c(OC)c1	C11H17NO3	unknown
+CCCSc1c(CCN)cc(OC)cc1OC	C13H21NO2S	unknown
+CCCSc1cc(CCN)c(OC)c(OC)c1	C13H21NO2S	unknown
+COc1cc(OC)c(CC(C)N)cc1F	C11H16FNO2	unknown
+COc1cc(OC)c(CCN)cc1Br	C10H14BrNO2	unknown
+COc1cc(OC)c(CC(C)N)cc1I	C11H16INO2	unknown
+NCCc1cc(N)c(O)cc1O	C8H12N2O2	unknown
+CC(N)Cc1cc(N)c(O)cc1O	C9H14N2O2	unknown
+COc1cc(OC)c(CCN)cc1N	C10H16N2O2	unknown
+COc1cc(OC)c(CC(C)N)cc1N	C11H18N2O2	unknown
+Cc1cc(C)c(CCN)cc1C	C11H17N	unknown
+Cc1cc(C)c(CC(C)N)cc1C	C12H19N	unknown
+CCc1cc(CC(C)N)c(OC)cc1OC	C13H21NO2	unknown
+NCCc1cc(O)c(N)cc1O	C8H12N2O2	unknown
+CC(N)Cc1cc(O)c(N)cc1O	C9H14N2O2	unknown
+Cc1cc(O)c(CC(C)N)cc1O	C10H15NO2	unknown
+NCCc1cc(O)c(O)cc1N	C8H12N2O2	unknown
+CC(N)Cc1cc(O)c(O)cc1N	C9H14N2O2	unknown
+CC(N)Cc1cc(O)c(O)cc1O	C9H13NO3	unknown
+CNC(C)Cc1cc(O)c(O)cc1O	C10H15NO3	unknown
+COc1cc(O)c(CCN)cc1O	C9H13NO3	unknown
+COc1cc(CC(C)NC(C)=O)c(OC)cc1Cl	C13H18ClNO3	unknown
+COc1cc(CC(C)NC(C)=O)c(OC)cc1Br	C13H18BrNO3	unknown
+CCCNC(C)Cc1cc(OC)c(Br)cc1OC	C14H22BrNO2	unknown
+CCOC(CN)c1cc(OC)c(Br)cc1OC	C12H18BrNO3	unknown
+COc1cc(C(=O)C(C)N)c(OC)cc1Br	C11H14BrNO3	beta-ketone
+COc1cc(C(CN)OC)c(OC)cc1I	C11H16INO3	unknown
+COc1cc(CC(C)NC(C)=O)c(OC)cc1I	C13H18INO3	unknown
+COc1cc(CC(C)NN)c(OC)cc1I	C11H17IN2O2	unknown
+COc1cc(CC(C)NO)c(OC)cc1I	C11H16INO3	unknown
+COCCNC(C)Cc1cc(OC)c(I)cc1OC	C14H22INO3	unknown
+CCCCCCN(C)C(C)Cc1cc(OC)c(I)cc1OC	C18H30INO2	unknown
+COc1cc(CCN)c(OC)cc1N	C10H16N2O2	unknown
+COc1cc(CC(C)NC(C)=O)c(OC)cc1N	C13H20N2O3	unknown
+COc1cc(N(C)C)c(OC)cc1CC(C)N	C13H22N2O2	unknown
+COc1cc([N+](=O)[O-])c(OC)cc1C(CN)OC	C11H16N2O5	unknown
+COc1cc([N+](=O)[O-])c(OC)cc1CC(C)NC(C)=O	C13H18N2O5	unknown
+COc1cc(CCNO)c(OC)cc1C	C11H17NO3	unknown
+COc1cc(C(C)CN)c(OC)cc1C	C12H19NO2	unknown
+COc1cc(C(C)(C)CN)c(OC)cc1C	C13H21NO2	unknown
+COc1cc(C(C)C(C)N)c(OC)cc1C	C13H21NO2	unknown
+COc1cc(C(C)(C)C(C)N)c(OC)cc1C	C14H23NO2	unknown
+COc1cc(CC(C)NO)c(OC)cc1C	C12H19NO3	unknown
+COc1cc(CC(C)N(C)C)c(OC)cc1C	C14H23NO2	unknown
+CCNC(C)Cc1cc(OC)c(C)cc1OC	C14H23NO2	unknown
+CC(C)CN(CCc1c[nH]c2ccccc12)CC(C)C	C18H28N2	tryptamine
+COc1cc(C(C)C(C)(C)N)c(OC)cc1C	C14H23NO2	unknown
+COc1cc(C(C)(C)C(C)(C)N)c(OC)cc1C	C15H25NO2	unknown
+COc1cc(C2CC2(C)N)c(OC)cc1C	C13H19NO2	unknown
+COc1cc(CC(C)N)c(OC)cc1CF	C12H18FNO2	unknown
+COc1cc(CCN)c(OC)cc1CO	C11H17NO3	unknown
+CCC(N)Cc1cc(OC)c(CO)cc1OC	C13H21NO3	unknown
+CCC(N)Cc1cc(OC)c(C(C)O)cc1OC	C14H23NO3	unknown
+CCc1cc(OC)c(C(CN)OC)cc1OC	C13H21NO3	unknown
+CCCCCCCc1cc(OC)c(CC(C)N)cc1OC	C18H31NO2	unknown
+CCCCCCCCCc1cc(OC)c(CC(C)N)cc1OC	C20H35NO2	unknown
+COc1cc(CC(C)N)c(OC)cc1CCO	C13H21NO3	unknown
+NCCc1c[nH]c2cc(O)c(O)cc12	C10H12N2O2	tryptamine
+COc1cc(CC(C)C)c(OC)cc1CCN	C14H23NO2	unknown
+COc1cc(F)c(CC(C)N)cc1OC	C11H16FNO2	unknown
+COc1cc(Cl)c(CCN)cc1OC	C10H14ClNO2	unknown
+COc1cc(N)c(CC(C)N)cc1OC	C11H18N2O2	unknown
+COc1cc(CC(C)N)c([N+](=O)[O-])cc1OC	C11H16N2O4	unknown
+CCc1cc(OC)c(OC)cc1CC(C)N	C13H21NO2	unknown
+COc1cc(OC)c(C(CN)OC)cc1OC	C12H19NO4	unknown
+COc1cc(OC)c(OC)cc1CC(C)N(C)C	C14H23NO3	unknown
+COc1cc(OC)c(C2CC2N)cc1OC	C12H17NO3	unknown
+CCC(N)Cc1cc(OC)c(OC)cc1OC	C13H21NO3	unknown
+CCCSc1cc(OC)c(OC)cc1CCN	C13H21NO2S	unknown
+COc1cc(OCC(C)O)c(OC)cc1CC(C)N	C14H23NO4	unknown
+COc1cc(OCCCO)c(OC)cc1CC(C)N	C14H23NO4	unknown
+COc1cc(OCc2ccccc2)c(OC)cc1CC(C)N	C18H23NO3	unknown
+CNC(C)Cc1cc(OC)c(SC)cc1OC	C13H21NO2S	unknown
+CCC(Cc1cc(OC)c(SC)cc1OC)NC	C14H23NO2S	unknown
+CCSc1cc(OC)c(CC(C)NC)cc1OC	C14H23NO2S	unknown
+CCSc1cc(OC)c(CC(N)CC)cc1OC	C14H23NO2S	unknown
+CCSc1cc(OC)c(CC(CC)NC)cc1OC	C15H25NO2S	unknown
+CCCSc1cc(OC)c(C(CN)OC)cc1OC	C14H23NO3S	unknown
+CCCSc1cc(OC)c(CC(C)NC)cc1OC	C15H25NO2S	unknown
+CCCSc1cc(OC)c(CC(N)CC)cc1OC	C15H25NO2S	unknown
+CCCSc1cc(OC)c(CC(CC)NC)cc1OC	C16H27NO2S	unknown
+CCCCSc1cc(OC)c(CC(C)N)cc1OC	C15H25NO2S	unknown
+CCCCCSc1cc(OC)c(CC(C)N)cc1OC	C16H27NO2S	unknown
+COc1cc(SCCc2ccccc2)c(OC)cc1CC(C)N	C19H25NO2S	unknown
+COc1cc(S(C)(=O)=O)c(OC)cc1CC(C)N	C12H19NO4S	unknown
+CCOc1cc(CCN)c(OC)cc1Br	C11H16BrNO2	unknown
+CCOc1cc(CC(C)N)c(OCC)cc1C	C14H23NO2	unknown
+CCCCCCc1cc(OCCCC)c(CC(C)N)cc1OCCCC	C23H41NO2	unknown
+Cc1c(CCN)cc2c(c1Br)COC2	C11H14BrNO	unknown
+Cc1c(CCN)cc2c(c1Cl)COC2	C11H14ClNO	unknown
+Cc1c(CCN)cc2c(c1[N+](=O)[O-])COC2	C11H14N2O3	unknown
+CC(N)Cc1cc2c(cc1F)OCO2	C10H12FNO2	unknown
+CC(N)Cc1cc2c(cc1Cl)OCO2	C10H12ClNO2	unknown
+CNC(C)Cc1cc2c(cc1Cl)OCO2	C11H14ClNO2	unknown
+NCCc1cc2c(cc1I)OCO2	C9H10INO2	unknown
+CC(N)Cc1cc2c(cc1I)OCO2	C10H12INO2	unknown
+CNC(C)Cc1cc2c(cc1I)OCO2	C11H14INO2	unknown
+CC(Cc1cc2c(cc1I)OCO2)N(C)C	C12H16INO2	unknown
+CC(N)Cc1cc2c(cc1[N+](=O)[O-])OCO2	C10H12N2O4	unknown
+CC(N)Cc1cc2c(cc1O)OCO2	C10H13NO3	unknown
+CNC(C)Cc1cc2c(cc1O)OCO2	C11H15NO3	unknown
+COc1cc2c(cc1C(C)CN)OCO2	C11H15NO3	unknown
+CCc1cc(SC)c(CC(C)N)cc1SC	C13H21NS2	unknown
+CCCSc1cc(CC(C)N)c(OC)cc1OC	C14H23NO2S	unknown
+COc1c(Cl)cc(CCN)cc1Cl	C9H11Cl2NO	unknown
+COc1c(Cl)cc(CC(C)N)cc1Cl	C10H13Cl2NO	unknown
+CCOc1c(Cl)cc(CCN)cc1Cl	C10H13Cl2NO	unknown
+CCCOc1c(Cl)cc(CCN)cc1Cl	C11H15Cl2NO	unknown
+C=CCOc1c(Cl)cc(CCN)cc1Cl	C11H13Cl2NO	unknown
+CCCCOc1c(Cl)cc(CCN)cc1Cl	C12H17Cl2NO	unknown
+COc1cc(CCN)cc(Cl)c1OC	C10H14ClNO2	unknown
+COc1cc(CC(C)N)cc(Cl)c1OC	C11H16ClNO2	unknown
+NCCc1cc(Cl)c2c(c1)OCO2	C9H10ClNO2	unknown
+COc1cc(CCN)cc(Br)c1O	C9H12BrNO2	unknown
+NCCc1cc(Br)c(O)c(Br)c1	C8H9Br2NO	unknown
+COc1c(Br)cc(CCN)cc1Br	C9H11Br2NO	unknown
+CC(N)Cc1cc(Br)c2c(c1)OCCO2	C11H14BrNO2	unknown
+CNCC(O)c1cc(C)c(C)c(C)c1	C12H19NO	unknown
+Cc1cc(CC(C)N)cc(C)c1O	C11H17NO	unknown
+COc1c(C)cc(CC(C)N)cc1C	C12H19NO	unknown
+COc1cc(CC(C)N)cc(C)c1OC	C12H19NO2	unknown
+NCCc1cc(O)c(O)c(O)c1	C8H11NO3	unknown
+CNCCc1cc(O)c(O)c(O)c1	C9H13NO3	unknown
+CC(N)Cc1cc(O)c(O)c(O)c1	C9H13NO3	unknown
+COc1cc(C(CN)OC)cc(O)c1O	C10H15NO4	unknown
+COc1c(O)cc(CCN)cc1O	C9H13NO3	unknown
+COc1cc(C(O)CN)cc(O)c1OC	C10H15NO4	unknown
+COc1cc(CC(C)N)cc(O)c1OC	C11H17NO3	unknown
+COc1cc(CC(C)N(C)C)cc(OC)c1I	C13H20INO2	unknown
+COc1cc(CC(C)N)cc(OC)c1C	C12H19NO2	unknown
+CCc1c(OC)cc(CC(C)N)cc1OC	C13H21NO2	unknown
+CNCCc1cc(OC)c(O)c(OC)c1	C11H17NO3	unknown
+COc1cc(CCN(C)C)cc(OC)c1O	C12H19NO3	unknown
+COc1cc(CCNC(C)C)cc(OC)c1O	C13H21NO3	unknown
+COc1cc(C(O)CN)cc(OC)c1O	C10H15NO4	unknown
+COc1cc(CC(C)N)cc(OC)c1O	C11H17NO3	unknown
+COc1cc(CCN)cc(Br)c1OC	C10H14BrNO2	unknown
+COc1cc(CC(C)N)cc(Br)c1OC	C11H16BrNO2	unknown
+CCc1cc(CC(C)N)cc(OC)c1OC	C13H21NO2	unknown
+COc1cc(C(O)C(C)N)cc(OC)c1OC	C12H19NO4	unknown
+COc1cc(CC(N)CO)cc(OC)c1OC	C12H19NO4	unknown
+COc1cc(CC(N)CCl)cc(OC)c1OC	C12H18ClNO3	unknown
+COc1cc(CC2CC=CCN2)cc(OC)c1OC	C15H21NO3	unknown
+COc1cc(CCN2CC=CC2)cc(OC)c1OC	C15H21NO3	unknown
+COc1cc(CC(C)(C)N)cc(OC)c1OC	C13H21NO3	unknown
+COc1cc(CC(C)(N)Cc2ccc3c(c2)OCO3)cc(OC)c1OC	C20H25NO5	unknown
+CCCCCCCCC(N)Cc1cc(OC)c(OC)c(OC)c1	C19H33NO3	unknown
+COc1cc(C(O)CN)cc(OC)c1OC	C11H17NO4	unknown
+CNCC(O)c1cc(OC)c(OC)c(OC)c1	C12H19NO4	unknown
+COc1cc(C(=O)CN)cc(OC)c1OC	C11H15NO4	beta-ketone
+COc1cc(CC[N+](C)(C)C)cc(OC)c1OC	C14H24NO3	unknown
+C=CCNCCc1cc(OC)c(OC)c(OC)c1	C14H21NO3	unknown
+COc1cc(CCNCCCl)cc(OC)c1OC	C13H20ClNO3	unknown
+COc1cc(CCNC2CC2)cc(OC)c1OC	C14H21NO3	unknown
+CCCNCCc1cc(OC)c(OC)c(OC)c1	C14H23NO3	unknown
+COc1cc(CCNCC2CC2)cc(OC)c1OC	C15H23NO3	unknown
+CCCSc1cc(CCN)cc(OC)c1OC	C13H21NO2S	unknown
+CNC(C)Cc1cc(O)c2c(c1)OCO2	C11H15NO3	unknown
+CNCCc1cc(OC)c2c(c1)OCO2	C11H15NO3	unknown
+CCC(N)Cc1cc(OC)c2c(c1)OCO2	C12H17NO3	unknown
+COc1ccc(Br)c(CCN)c1OC	C10H14BrNO2	unknown
+Cc1ccc(C)c(CCN)c1C	C11H17N	unknown
+Cc1ccc(C)c(CC(C)N)c1C	C12H19N	unknown
+COc1ccc(C)c(CC(C)N)c1OC	C12H19NO2	unknown
+CCc1ccc(OC)c(OC)c1CC(C)N	C13H21NO2	unknown
+COc1ccc(Br)c(OC)c1CCN	C10H14BrNO2	unknown
+COc1ccc(C)c(OC)c1CC(C)N	C12H19NO2	unknown
+CCc1ccc(OC)c(CC(C)N)c1OC	C13H21NO2	unknown
+CCCSc1ccc(OC)c(CCN)c1OC	C13H21NO2S	unknown
+COc1ccc(OC)c(CCN)c1Br	C10H14BrNO2	unknown
+COc1ccc(OC)c(CC(C)N)c1Br	C11H16BrNO2	unknown
+COc1ccc(OC)c(CC(C)N)c1C	C12H19NO2	unknown
+CCc1c(OC)ccc(OC)c1CC(C)N	C13H21NO2	unknown
+CCCSc1c(OC)ccc(OC)c1CCN	C13H21NO2S	unknown
+COc1ccc2c(c1CC(C)N)CCO2	C12H17NO2	unknown
+CCCSc1ccc(OC)c(OC)c1CCN	C13H21NO2S	unknown
+Cc1cc(C)c(CCN)c(C)c1	C11H17N	unknown
+Cc1cc(C)c(CC(C)N)c(C)c1	C12H19N	unknown
+COc1cc(C)c(CCN)c(C)c1	C11H17NO	unknown
+COc1cc(C)c(CCN)c(OC)c1	C11H17NO2	unknown
+COc1cc(C)cc(C)c1CCN	C11H17NO	unknown
+CCOc1cc(C)c(CCN)c(C)c1	C12H19NO	unknown
+CCc1cc(CC)c(CCN)c(CC)c1	C14H23N	unknown
+COc1cc(C(F)(F)F)cc(OC)c1CC(C)N	C12H16F3NO2	unknown
+COc1cc(O)cc(OC)c1CCN	C10H15NO3	unknown
+COc1cc(Br)c(CCN)c(OC)c1	C10H14BrNO2	unknown
+COc1cc(Br)c(CC(C)N)c(OC)c1	C11H16BrNO2	unknown
+CCc1cc(OC)cc(OC)c1CC(C)N	C13H21NO2	unknown
+CCCSc1cc(OC)cc(OC)c1CCN	C13H21NO2S	unknown
+CCSc1cc(OC)c(CC(C)N)c(OC)c1	C13H21NO2S	unknown
+CCCSc1cc(OC)c(CCN)c(OC)c1	C13H21NO2S	unknown
+CCOc1cc(C)cc(C)c1CCN	C12H19NO	unknown
+CCOc1cc(C)cc(OC)c1CC(C)N	C13H21NO2	unknown
+CCOc1cc(OC)cc(C)c1CCN	C12H19NO2	unknown
+CCOc1cc(C)c(CCN)c(OCC)c1	C13H21NO2	unknown
+CCOc1cc(OCC)c(CCN)c(OCC)c1	C14H23NO3	unknown
+CCCCOc1cc(CCCC)cc(OCCCC)c1CCN	C20H35NO2	unknown
+Cc1cc(CCN)c(C)c(C)c1C	C12H19N	unknown
+Cc1cc(CC(C)N)c(C)c(C)c1C	C13H21N	unknown
+CCc1c(C)c(OC)cc(CCN)c1OC	C13H21NO2	unknown
+CCc1c(C)c(OC)cc(CC(C)N)c1OC	C14H23NO2	unknown
+CCc1c(OC)cc(CCN)c(OC)c1C	C13H21NO2	unknown
+CCc1c(OC)cc(CC(C)N)c(OC)c1C	C14H23NO2	unknown
+CCc1c(OC)cc(CCN)c(OC)c1CC	C14H23NO2	unknown
+CCc1c(OC)cc(CC(C)N)c(OC)c1CC	C15H25NO2	unknown
+COc1cc(CCN)c(OC)c2c1C2	C11H15NO2	unknown
+COc1cc(CC(C)N)c(OC)c2c1C2	C12H17NO2	unknown
+COc1cc(CC(C)N)c(OC)c2c1C1CCC2CC1	C17H25NO2	unknown
+COc1cc(CCN)c(Cl)c(OC)c1OC	C11H16ClNO3	unknown
+COc1cc(CCN)c(Br)c(OC)c1OC	C11H16BrNO3	unknown
+COc1cc2c(c(OC)c1OC)CCC(N)C2	C13H19NO3	unknown
+COc1cc(CCN)c2c(c1OC)OCO2	C11H15NO4	unknown
+CNCCc1cc(OC)c(OC)c2c1OCO2	C12H17NO4	unknown
+COc1cc(CC(C)N)c2c(c1OC)OCO2	C12H17NO4	unknown
+COc1cc(CCN)c(OC)c2c1OCO2	C11H15NO4	unknown
+CNCCc1cc(OC)c2c(c1OC)OCO2	C12H17NO4	unknown
+COc1c(CCN)cc2c(c1OC)OCO2	C11H15NO4	unknown
+CNCCc1cc2c(c(OC)c1OC)OCO2	C12H17NO4	unknown
+Cc1cc(C)c(CCN)c(C)c1C	C12H19N	unknown
+Cc1cc(C)c(CC(C)N)c(C)c1C	C13H21N	unknown
+COc1cc(C)c(OC)c2c1CC(N(C)C)C2	C14H21NO2	unknown
+COc1cc(C)c(OC)c2c1CC(N)C=C2	C13H17NO2	unknown
+COc1cc(OC)c(OC)c(OC)c1CCN	C12H19NO4	unknown
+COc1cc(OC)c(OC)c(OC)c1CC(C)N	C13H21NO4	unknown
+COc1cc(I)c2c(c1CC(C)N)CCO2	C12H16INO2	unknown
+COc1cc(OC)c2c(c1CCN)OCO2	C11H15NO4	unknown
+COc1cc(OC)c2c(c1CC(C)N)OCO2	C12H17NO4	unknown
+COc1cc2c(c(OC)c1CCN)OCO2	C11H15NO4	unknown
+COc1cc2c(c(OC)c1CC(C)N)OCO2	C12H17NO4	unknown
+COc1cc(OC)c(Br)c(CCN)c1Br	C10H13Br2NO2	unknown
+Cc1cc(C)c(C)c(CCN)c1C	C12H19N	unknown
+Cc1cc(C)c(C)c(CC(C)N)c1C	C13H21N	unknown
+COc1cc(OC)c(OC)c(CC(C)N)c1OC	C13H21NO4	unknown
+COc1cc2c(c(CCN)c1OC)OCO2	C11H15NO4	unknown
+COc1cc2c(c(CC(C)N)c1OC)OCO2	C12H17NO4	unknown
+NCCc1c2ccoc2cc2ccoc12	C12H11NO2	unknown
+NCCc1c2c(cc3c1OCCC3)OCCC2	C14H19NO2	unknown
+CC(N)Cc1c2c(cc3c1OCCC3)OCCC2	C15H21NO2	unknown
+COc1c(Cl)c(CCN)c(Cl)c(OC)c1OC	C11H15Cl2NO3	unknown
+COc1c(Br)c(CCN)c(Br)c(OC)c1OC	C11H15Br2NO3	unknown
+Cc1c(C)c(C)c(CCN)c(C)c1C	C13H21N	unknown
+Cc1c(C)c(C)c(CC(C)N)c(C)c1C	C14H23N	unknown
+COc1c(C)c(C)c(OC)c(CCN)c1C	C13H21NO2	unknown
+COc1c(CC(C)N)c(OC)c(OC)c(OC)c1OC	C14H23NO5	unknown
+COc1c(CC(C)N)c(OC)c2c(c1OC)OCO2	C13H19NO5	unknown
+Cc1c2c(c(CC(C)N)c3c1CCO3)OCC2	C14H19NO2	unknown
+NCCc1c2c(c(I)c3c1OCC3)OCC2	C12H14INO2	unknown
+CC(N)Cc1c2c(c(I)c3c1OCC3)OCC2	C13H16INO2	unknown
+NCCc1c2ccoc2c(I)c2ccoc12	C12H10INO2	unknown
+CC(N)Cc1c2ccoc2c(I)c2ccoc12	C13H12INO2	unknown
+Cc1c2ccoc2c(CC(C)N)c2ccoc12	C14H15NO2	unknown
+CCc1[nH]c2ccc(OC)cc2c1CCN(C)C	C15H22N2O	tryptamine
+CC(N)C(N)c1ccccc1	C9H14N2	unknown
+COc1ccc(C(=O)C(C)N)cc1OC	C11H15NO3	beta-ketone
+COc1cc(OC)cc(C(=O)C(C)N)c1	C11H15NO3	beta-ketone
+CC(N)C(=O)c1ccc(F)cc1	C9H10FNO	beta-ketone
+CC(N)C(=O)c1ccc(Cl)cc1	C9H10ClNO	beta-ketone
+COc1ccccc1C(=O)C(C)N	C10H13NO2	beta-ketone
+CCCCOc1ccc(CC(C)N)cc1	C13H21NO	unknown
+CSc1ccc(CC(C)NCc2ccc(OCc3ccccc3)cc2)cc1	C24H27NOS	unknown
+CCCCOc1ccc(CNC(C)Cc2ccc(SC)cc2)cc1	C21H29NOS	unknown
+COc1ccc(CNC(C)Cc2ccc(SC)cc2)cc1	C18H23NOS	unknown
+CSc1ccc(CC(C)NCc2ccc(O)cc2)cc1	C17H21NOS	unknown
+CSc1ccc(CC(C)NCc2ccccc2)cc1	C17H21NS	unknown
+CC(N)Cc1cccc2ccccc12	C13H15N	unknown
+CC(N)Cc1cccc2[nH]ccc12	C11H14N2	unknown
+COc1cc(CC(C)N)c(OCc2ccccc2)cc1C	C18H23NO2	unknown
+CC(N)Cc1cccc2occc12	C11H13NO	unknown
+CNC(C)Cc1cccs1	C8H13NS	unknown
+CC(N)Cc1cccc(Br)c1	C9H12BrN	unknown
+C#CCN(C)C(C)Cc1ccccc1	C13H17N	unknown
+CC(N)Cc1cccc(I)c1	C9H12IN	unknown
+CC(N)Cc1ccccc1I	C9H12IN	unknown
+CNC(C)C(=O)c1ccc(C(F)(F)F)cc1	C11H12F3NO	beta-ketone
+CNC(C)C(=O)c1cccc(C(F)(F)F)c1	C11H12F3NO	beta-ketone
+CNC(C)C(=O)c1ccccc1C(F)(F)F	C11H12F3NO	beta-ketone
+Cc1ccc(C(=O)C(C)NCc2ccccc2)cc1	C17H19NO	beta-ketone
+CN(C)CCc1c[nH]c2c(F)ccc(O)c12	C12H15FN2O	tryptamine
+COc1ccc2[nH]cc(CCN(C)C)c2c1F	C13H17FN2O	tryptamine
+COc1cc2c(CCN(C)C)c[nH]c2cc1F	C13H17FN2O	tryptamine
+COc1ccc2[nH]cc(CCN3CCCC3)c2c1F	C15H19FN2O	tryptamine
+CN(C)CCc1c[nH]c2ccsc12	C10H14N2S	unknown
+CN(C)CCc1c[nH]c2sccc12	C10H14N2S	unknown
+CN(C)CCc1csc2ccccc12	C12H15NS	unknown
+CN(C)CCC1=CCc2ccccc21	C13H17N	unknown
+COc1ccc2occ(CCN(C)C)c2c1	C13H17NO2	unknown
+COc1ccc2occ(CC(C)N)c2c1	C12H15NO2	unknown
+N[C@H]1C[C@@H]1c1c[nH]c2ccccc12	C11H12N2	tryptamine
+N[C@@H]1C[C@H]1c1c[nH]c2ccccc12	C11H12N2	tryptamine
+CCCN(CC)CCc1c[nH]c2ccccc12	C15H22N2	tryptamine
+NCCc1c[nH]c2ccc(C(N)=O)cc12	C11H13N3O	tryptamine
+C[C@@H]1CC[C@H](C)N1C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C22H27N3O	unknown
+C[C@@H]1C[C@@H](C)N1C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C21H25N3O	unknown
+C[C@@H]1C[C@H](C)N1C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C21H25N3O	unknown
+CCN(CC(F)(F)F)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C20H22F3N3O	unknown
+CN(C)CCc1c[nH]c2cc(F)cc(O)c12	C12H15FN2O	prophetic,tryptamine
+CCN(CC)C(=O)N[C@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C20H26N4O	unknown
+CC(NC(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1)C(C)c1ccccc1	C26H29N3O	unknown
+CC1C(C)N1C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C20H23N3O	unknown
+CNS(=O)(=O)Cc1ccc2[nH]cc(CCN(C)C)c2c1	C14H21N3O2S	tryptamine
+NCCc1c[nH]c2ccc(OCc3ccccc3)cc12	C17H18N2O	tryptamine
+Cc1ccc2[nH]cc(CCN)c2c1	C11H14N2	tryptamine
+COc1ccc2[nH]cc(CCNC(C)C)c2c1	C14H20N2O	tryptamine
+Cc1ccc2[nH]cc(CCN(C)C(C)C)c2c1	C15H22N2	tryptamine
+Cc1cccc2c(CCN)c[nH]c12	C11H14N2	tryptamine
+CC(C)N(CCc1c[nH]c2ccc(O)cc12)C(C)C	C16H24N2O	tryptamine
+NCc1c[nH]c2ccccc12	C9H10N2	unknown
+CCCN(C)CCc1c[nH]c2ccc(OC)cc12	C15H22N2O	tryptamine
+CCCN(CC)CCc1c[nH]c2ccc(OC)cc12	C16H24N2O	tryptamine
+COc1ccc2[nH]cc(CCN(CC(C)C)CC(C)C)c2c1	C19H30N2O	tryptamine
+CC(N)Cc1cc(F)c2c(c1)OCO2	C10H12FNO2	unknown
+CC(N)Cc1ccc2c(c1F)OCO2	C10H12FNO2	unknown
+COc1cc(CC(C)N)cc(OC)c1OC(F)F	C12H17F2NO3	unknown
+COc1cc(CCN)cc(OC)c1OC(CF)CF	C13H19F2NO3	unknown
+COc1cc(CCN)cc(OC)c1OCCC(F)(F)F	C13H18F3NO3	unknown
+COc1cc(CCN)cc(OC(F)F)c1OC	C11H15F2NO3	unknown
+COc1cc(CCN)cc(OC)c1OC(F)(F)F	C11H14F3NO3	unknown
+COc1cc(CCN)cc(OC)c1OC(F)F	C11H15F2NO3	unknown
+COc1cc(CC(F)F)cc(OC)c1CC(C)N	C13H19F2NO2	unknown
+COc1cc(CC(F)F)cc(OC)c1CCN	C12H17F2NO2	unknown
+COc1cc(OCC(F)(F)F)cc(OC)c1CC(C)N	C13H18F3NO3	unknown
+COc1cc(OCC(F)F)cc(OC)c1CC(C)N	C13H19F2NO3	unknown
+COc1cc(OCCF)cc(OC)c1CC(C)N	C13H20FNO3	unknown
+COc1cc(OCC(F)(F)F)cc(OC)c1CCN	C12H16F3NO3	unknown
+COc1cc(OCC(F)F)cc(OC)c1CCN	C12H17F2NO3	unknown
+COc1cc(OCCF)cc(OC)c1CCN	C12H18FNO3	unknown
+COc1cc(CC(F)(F)F)c(OC)cc1CC(C)N	C13H18F3NO2	unknown
+COc1cc(CC(F)(F)F)c(OC)cc1CCN	C12H16F3NO2	unknown
+COc1ccc(OC(F)(F)F)cc1CCN	C10H12F3NO2	unknown
+COc1cc(CCN)c(OC(F)F)cc1Br	C10H12BrF2NO2	unknown
+COc1cc(OCC(F)(F)F)c(OC)cc1CC(C)N	C13H18F3NO3	unknown
+COc1cc(OCC(F)F)c(OC)cc1CC(C)N	C13H19F2NO3	unknown
+COc1cc(OCCF)c(OC)cc1CC(C)N	C13H20FNO3	unknown
+COc1cc(OCC(F)(F)F)c(OC)cc1CCN	C12H16F3NO3	unknown
+COc1cc(OCC(F)F)c(OC)cc1CCN	C12H17F2NO3	unknown
+COc1cc(OCCF)c(OC)cc1CCN	C12H18FNO3	unknown
+NCCc1cc(OC(F)(F)C(F)F)c(OC(F)(F)C(F)F)c(OC(F)(F)C(F)F)c1	C14H11F12NO3	unknown
+CC(Cc1ccccc1)NCC(F)(F)F	C11H14F3N	unknown
+CC(N)C(F)(F)c1ccccc1	C9H11F2N	unknown
+CC(N)C(F)c1ccccc1	C9H12FN	unknown
+NC(CF)Cc1ccccc1	C9H12FN	unknown
+COc1cc(CC(N)C(F)(F)F)cc(OC)c1OC	C12H16F3NO3	unknown
+CCN(CCOC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C21H27N3O2	unknown
+Cc1ccc2c(CCN(C)C)c[nH]c2c1	C13H18N2	tryptamine
+NC(Cc1ccccc1)C(F)(F)F	C9H10F3N	unknown
+CCCN(CC)CCc1c[nH]c2ccc(OCC)cc12	C17H26N2O	tryptamine
+CCOc1ccc2[nH]cc(CCN(C)CC)c2c1	C15H22N2O	tryptamine
+C=CCN(CCc1c[nH]c2ccc(OCC)cc12)C1CCCCC1	C21H30N2O	tryptamine
+C=C(C)CN(CC)CCc1c[nH]c2ccc(OCC)cc12	C18H26N2O	tryptamine
+CCOc1ccc2[nH]cc(CCN(CC)C(C)C)c2c1	C17H26N2O	tryptamine
+CCOc1ccc2[nH]cc(CCN(C)C(C)C)c2c1	C16H24N2O	tryptamine
+CCCN(C)CCc1c[nH]c2ccc(OCC)cc12	C16H24N2O	tryptamine
+C=CCN(CC=C)CCc1c[nH]c2ccc(OCC)cc12	C18H24N2O	tryptamine
+CCOc1ccc2[nH]cc(CCN(C(C)C)C(C)C)c2c1	C18H28N2O	tryptamine
+CCCN(CCC)CCc1c[nH]c2ccc(OCC)cc12	C18H28N2O	tryptamine
+CCOc1ccc2[nH]cc(CCN(CC)CC)c2c1	C16H24N2O	tryptamine
+C=CCN(C)CCc1c(C)[nH]c2ccc(OC)cc12	C16H22N2O	tryptamine
+C=C(C)CN(CC)CCc1c(C)[nH]c2ccc(OC)cc12	C18H26N2O	tryptamine
+CCCN(CC)CCc1c(C)[nH]c2ccc(OC)cc12	C17H26N2O	tryptamine
+CCN(C)CCc1c(C)[nH]c2ccc(OC)cc12	C15H22N2O	tryptamine
+CCN(CCc1c(C)[nH]c2ccc(OC)cc12)C(C)C	C17H26N2O	tryptamine
+COc1ccc2[nH]c(C)c(CCN(C)C(C)C)c2c1	C16H24N2O	tryptamine
+CCCN(C)CCc1c(C)[nH]c2ccc(OC)cc12	C16H24N2O	tryptamine
+C=CCN(CC=C)CCc1c(C)[nH]c2ccc(OC)cc12	C18H24N2O	tryptamine
+COc1ccc2[nH]c(C)c(CCN(C(C)C)C(C)C)c2c1	C18H28N2O	tryptamine
+CCCN(CCC)CCc1c(C)[nH]c2ccc(OC)cc12	C18H28N2O	tryptamine
+CCN(CC)CCc1c(C)[nH]c2ccc(OC)cc12	C16H24N2O	tryptamine
+COc1ccc2[nH]c(-c3ccccc3)c(CCN(C)C)c2c1	C19H22N2O	tryptamine
+CCc1[nH]c2ccc(OC)cc2c1CC1CCCN1C	C17H24N2O	unknown
+NC1CCc2ccccc2C1=O	C10H11NO	unknown
+NCC1=CCCc2ccccc21	C11H13N	unknown
+COc1ccc2c(c1)C(CN)=CCO2	C11H13NO2	unknown
+NCC1=CCOc2ccccc21	C10H11NO	unknown
+COc1ccc2cc(CC(C)N)ccc2c1	C14H17NO	unknown
+CCOc1ccc2cc(CC(C)N)ccc2c1	C15H19NO	unknown
+CCCOc1ccc2cc(CC(C)N)ccc2c1	C16H21NO	unknown
+CCCCOc1ccc2cc(CC(C)N)ccc2c1	C17H23NO	unknown
+CC(N)Cc1ccc2cc(OCc3ccccc3)ccc2c1	C20H21NO	unknown
+CSc1ccc2cc(CC(C)N)ccc2c1	C14H17NS	unknown
+COc1ccc2cc(CC(C)NCc3ccccc3)ccc2c1	C21H23NO	unknown
+CCCCOc1ccc2cc(CC(C)NCc3ccccc3)ccc2c1	C24H29NO	unknown
+CCCC(C(=O)c1cccc2ccccc12)N1CCCC1	C19H23NO	beta-ketone
+COc1cc(CCN)c(OC)cc1[At]	C10H14AtNO2	unknown
+CN[C@@H](C)Cc1ccc2c(c1)OCO2	C11H15NO2	unknown
+CN[C@H](C)Cc1ccc2c(c1)OCO2	C11H15NO2	unknown
+CCCCNC(C)Cc1ccc(SC)cc1	C14H23NS	unknown
+NCCc1c[nH]c2c(Br)cccc12	C10H11BrN2	tryptamine
+COc1cc(C)c2[nH]cc(CCN(C)C)c2c1	C14H20N2O	prophetic,tryptamine
+CCCN(CCC)C1Cc2c[nH]c3ccc(C(C)=O)c(c23)C1	C19H26N2O	unknown
+O=C(O)Cc1c[nH]c2ccccc12	C10H9NO2	unknown
+OCCc1c[nH]c2ccccc12	C10H11NO	unknown
+CN(C)CCc1c[nH]c2c(O)cccc12	C12H16N2O	tryptamine
+COc1ccc(OC)c(CC(N)C(=O)O)c1	C11H15NO4	unknown
+COc1cc(CC(N)C(=O)O)c(OC)cc1Br	C11H14BrNO4	unknown
+CCCN(CCC)C1CCc2cccc(OC)c2C1	C17H27NO	unknown
+COc1ccc(CCCc2ccccc2)cc1CC(C)N	C19H25NO	unknown
+COc1ccc(CCCCc2ccccc2)cc1CCN	C19H25NO	unknown
+COc1ccc(CCCCCc2ccccc2)cc1CCN	C20H27NO	unknown
+COc1ccc(CCCC2CCCCC2)cc1CCN	C18H29NO	unknown
+COc1ccc(C#CCCCc2ccccc2)cc1CCN	C20H23NO	unknown
+COc1ccc(-c2ccccc2)cc1CCN	C15H17NO	unknown
+CC(N)Cc1cc[nH]c1	C7H12N2	unknown
+CCCn1ccc(CC(C)N)c1	C10H18N2	unknown
+CCCCCn1ccc(CC(C)N)c1	C12H22N2	unknown
+CC1NCCOC1c1ccc2c(c1)OCO2	C12H15NO3	unknown
+CN1CCc2cccc3c2[C@H]1Cc1ccc(O)c(O)c1-3	C17H17NO2	unknown
+CCN(C)Cc1ccc2c(c1)OCO2	C11H15NO2	unknown
+COc1cc(C2CCNC2)cc(OC)c1OC	C13H19NO3	unknown
+COc1cc(C)c(OC)c2c1CC(N)C2O	C12H17NO3	unknown
+NC1CC1c1ccc(O)c(O)c1	C9H11NO2	unknown
+CN(C)C1CC1c1ccccc1O	C11H15NO	unknown
+CCN(CC)C1CC1c1ccccc1O	C13H19NO	unknown
+CCCN(CCC)C1CC1c1ccccc1O	C15H23NO	unknown
+CCCCN(CCCC)C1CC1c1ccccc1O	C17H27NO	unknown
+CCCN(CCC)C1CC1c1ccccc1OC	C16H25NO	unknown
+CCCN(CCC)C1CC1c1cccc(OC)c1	C16H25NO	unknown
+CN(C)C1CC1c1cccc(O)c1	C11H15NO	unknown
+CCN(CC)C1CC1c1cccc(O)c1	C13H19NO	unknown
+CCCN(CCC)C1CC1c1cccc(O)c1	C15H23NO	unknown
+CCCCN(CCCC)C1CC1c1cccc(O)c1	C17H27NO	unknown
+CCCN(CCC)C1CC1c1ccc(O)cc1	C15H23NO	unknown
+CCCN(CCC)C1CC1c1ccc(O)c(O)c1	C15H23NO2	unknown
+CC1Cc2cc3c(cc2C(=O)N1)OCO3	C11H11NO3	unknown
+COc1cc2c(cc1OC)C(C)N(C)CC2	C13H19NO2	unknown
+COc1cc2c(cc1OC)C(C)N(C)CC2O	C13H19NO3	unknown
+CC(N)Cc1ccc(S(C)=O)cc1	C10H15NOS	unknown
+CC(N)Cc1ccc(S(C)(=O)=O)cc1	C10H15NO2S	unknown
+CCS(=O)c1cc(OC)c(CC(C)N)cc1OC	C13H21NO3S	unknown
+CCS(=O)(=O)c1cc(OC)c(CC(C)N)cc1OC	C13H21NO4S	unknown
+COc1cc(CC(N)C(=O)O)cc(OC)c1OC	C12H17NO5	unknown
+COc1cc(CC(N)C(=O)O)c(OC)cc1C	C12H17NO4	unknown
+CC(Cc1ccc2c(c1)OCO2)N(C)C=O	C12H15NO3	unknown
+CNC(C)C(OC)c1ccc2c(c1)OCO2	C12H17NO3	unknown
+CNC(C)C(=O)c1ccccc1C	C11H15NO	beta-ketone
+CNC(C)C(=O)c1cccc(C)c1	C11H15NO	beta-ketone
+COc1cc(CC(C)NC(=O)c2ccccc2)c(OC)cc1C	C19H23NO3	unknown
+COc1cc(CC(C)NC(=O)C2CCCN2C(=O)c2c(F)c(F)c(F)c(F)c2F)c(OC)cc1C	C24H25F5N2O4	unknown
+COc1cc(CC(C)NC(=O)C2CCCN2C(=O)c2c(F)c(F)c(F)c(F)c2F)c(OC)cc1Br	C23H22BrF5N2O4	unknown
+COc1cc(Cc2ccccc2)ccc1CCN	C16H19NO	unknown
+COc1cc(CCc2ccccc2)ccc1CCN	C17H21NO	unknown
+COc1cc(CCCc2ccccc2)ccc1CCN	C18H23NO	unknown
+COc1cc(CCCCc2ccccc2)ccc1CCN	C19H25NO	unknown
+COc1cc(CCCCCc2ccccc2)ccc1CCN	C20H27NO	unknown
+COc1cc(CCCC2CCCCC2)ccc1CCN	C18H29NO	unknown
+COc1cc(OCCc2ccccc2)ccc1CCN	C17H21NO2	unknown
+COc1cc(C#CCCCc2ccccc2)ccc1CCN	C20H23NO	unknown
+COc1cc(-c2ccccc2)ccc1CCN	C15H17NO	unknown
+COc1ccc(O)cc1CCN	C9H13NO2	unknown
+COc1ccc(OCc2ccccc2)cc1CCN	C16H19NO2	unknown
+COc1ccc(I)cc1CCN	C9H12INO	unknown
+COc1ccc(OCCc2ccccc2)cc1CCN	C17H21NO2	unknown
+COc1ccc(OCCc2ccc(Br)cc2)cc1CCN	C17H20BrNO2	unknown
+COc1ccc(Cc2ccccc2)cc1CCN	C16H19NO	unknown
+COc1ccc(CCc2ccccc2)cc1CCN	C17H21NO	unknown
+COc1ccc(CCCc2ccccc2)cc1CCN	C18H23NO	unknown
+CN(C)CCc1c[nH]c2ccc3c(c12)CCCO3	C15H20N2O	tryptamine
+CN(C)CCc1c[nH]c2cc3c(cc12)OCCC3	C15H20N2O	tryptamine
+CN(C)CCc1cn(C)c2ccc3c(c12)CCCO3	C16H22N2O	tryptamine
+NCCc1c[nH]c2ccc3c(c12)CCCO3	C13H16N2O	tryptamine
+COc1cccc2[nH]c3c(C)nccc3c12	C13H12N2O	unknown
+COc1cccc2c1[nH]c1c(C)nccc12	C13H12N2O	unknown
+COc1cccc2[nH]c3c(c12)CCN=C3C	C13H14N2O	unknown
+COc1cccc2c3c([nH]c12)C(C)=NCC3	C13H14N2O	unknown
+COC(=O)C1Cc2c([nH]c3ccccc23)C(C)=N1	C14H14N2O2	unknown
+Cc1nccc2c3ccccc3n(C)c12	C13H12N2	unknown
+COc1cccc2[nH]c3c(c12)CCNC3C	C13H16N2O	unknown
+COc1cccc2c3c([nH]c12)C(C)NCC3	C13H16N2O	unknown
+COC(=O)c1cc2c(cn1)[nH]c1ccccc12	C13H10N2O2	unknown
+CNC(=O)c1cc2c(cn1)[nH]c1ccccc12	C13H11N3O	unknown
+COc1ccc2c3c([nH]c2c1)CN(C)CC3	C13H16N2O	unknown
+CCCn1cc(CC(C)N)c2ccccc21	C14H20N2	tryptamine
+CCCCCn1cc(CC(C)N)c2ccccc21	C16H24N2	tryptamine
+CCCc1cccc2c(CC(C)N)c[nH]c12	C14H20N2	tryptamine
+CCCCCc1cccc2c(CC(C)N)cn(C)c12	C17H26N2	tryptamine
+CCCn1cc(CC(C)N)c2cc(OC)ccc21	C15H22N2O	tryptamine
+COc1ccc2c(c1)c(CC(C)N)cn2Cc1ccccc1	C19H22N2O	tryptamine
+CCCCCCCCn1cc(CC(C)N)c2ccccc21	C19H30N2	tryptamine
+CC(N)Cc1cn(Cc2ccccc2)c2ccccc12	C18H20N2	tryptamine
+CCCCN(CCCC)CCc1c[nH]c2ccc(OC)cc12	C19H30N2O	tryptamine
+CC(C)CN(C)CCc1c[nH]c2ccccc12	C15H22N2	tryptamine
+COc1ccc2[nH]cc(CCN(C)CC(C)C)c2c1	C16H24N2O	tryptamine
+CCCN(CCC)CCc1c[nH]c2ccc(O)cc12	C16H24N2O	tryptamine
+COc1ccc(OC)c2c1CC(N)C2	C11H15NO2	unknown
+CC(C)NCC(O)c1cccc(O)c1O	C11H17NO3	unknown
+CC(Cc1ccc2c(c1)OCO2)NC1CC1	C13H17NO2	unknown
+NC(Cc1ccc2c(c1)OCO2)C1CC1	C12H15NO2	unknown
+NC1=NC(=O)C(c2ccc3c(c2)OCO3)O1	C10H8N2O4	unknown
+COc1ccc2c(c1Br)CC(N)CCO2	C11H14BrNO2	unknown
+CNC(C)Cc1ccc(C(F)(F)F)cc1	C11H14F3N	unknown
+COc1cc(C2C(C)C2N)c(OC)cc1C	C13H19NO2	unknown
+COc1cc(C2CCC2N)c(OC)cc1C	C13H19NO2	unknown
+COc1cc(OC)c(C2CCC2N)cc1OC	C13H19NO3	unknown
+COc1ccc(CC[N+](C)(C)C)cc1	C12H20NO	unknown
+COC(C[N+](C)(C)C)c1ccccc1	C12H20NO	unknown
+CCOc1cc(C)cc(OCC)c1CC(C)N	C14H23NO2	unknown
+CCCCOc1cc(CC(C)N)c(OCCCC)cc1C	C18H31NO2	unknown
+CCCOc1cc(C)cc(OCCC)c1CC(C)N	C16H27NO2	unknown
+CCOc1cc(CC(C)N)c(OCC)cc1CC	C15H25NO2	unknown
+CCOc1cc(CC)cc(OCC)c1CC(C)N	C15H25NO2	unknown
+CCOc1cc(CC)cc(OC)c1CC(C)N	C14H23NO2	unknown
+CCOc1cc(CC(C)N)c(OC)cc1CC	C14H23NO2	unknown
+CCOc1cc(CC)c(OC)cc1CC(C)N	C14H23NO2	unknown
+CCCCCCc1cc(OCC)c(CC(C)N)c(OCC)c1	C19H33NO2	unknown
+CCCCOc1cc(CCC)cc(OCCCC)c1CC(C)N	C20H35NO2	unknown
+CCCCOc1cc(C)c(OC)cc1CC(C)N	C15H25NO2	unknown
+CCCCOc1cc(CC(C)N)c(OCCCC)cc1CCCC	C21H37NO2	unknown
+CCCCCc1cc(OCCC)c(CC(C)N)cc1OCCC	C20H35NO2	unknown
+COc1cc(OC)c(OC)cc1CC(N)C(=O)O	C12H17NO5	unknown
+NC(Cc1ccc(O)c(O)c1)C(=O)O	C9H11NO4	unknown
+COc1cc(OC)c(CC(C)NC(=O)c2ccccc2)c(OC)c1	C19H23NO4	unknown
+NC1C=Cc2ccccc2C1	C10H11N	unknown
+COc1cc(Br)c2c3c1C(CN)CCCC3CO2	C14H18BrNO2	unknown
+COc1cc(C2CNCc3ccccc32)c(OC)cc1Br	C17H18BrNO2	unknown
+COc1cc(C2CNCc3ccccc3C2)c(OC)cc1Br	C18H20BrNO2	unknown
+COc1cc(Br)c2c3c1C(CN)CCC3CO2	C13H16BrNO2	unknown
+COc1cc(Br)c2occ3c2c1C(CN)CC3	C13H14BrNO2	unknown
+COc1cc2c(cc1Br)OCCC(N)C2	C11H14BrNO2	unknown
+COc1cc2c(cc1I)OCCC(N)C2	C11H14INO2	unknown
+COc1cc2c(cc1C(F)(F)F)OCCC(N)C2	C12H14F3NO2	unknown
+COc1ccc2c3c1CC(N)CC3CO2	C12H15NO2	unknown
+COc1cc(Br)c2c3c1CC(N)CC3CO2	C12H14BrNO2	unknown
+COc1ccc2c3c1CC(N(C)C)CC3CO2	C14H19NO2	unknown
+CCCN(CCC)C1Cc2c(OC)ccc3c2C(CO3)C1	C18H27NO2	unknown
+c1ccc(C(c2ccccc2)C2CCCCN2)cc1	C18H21N	unknown
+OC(c1ccccc1)(c1ccccc1)C1CCCCN1	C18H21NO	unknown
+c1ccc(C(c2ccccc2)C2CCCN2)cc1	C17H19N	unknown
+OC(c1ccccc1)(c1ccccc1)C1CCCN1	C17H19NO	unknown
+NC1=NCC(c2ccccc2)O1	C9H10N2O	unknown
+CC1N=C(N)OC1c1ccccc1	C10H12N2O	unknown
+Cc1ccc(C2CN=C(N)O2)cc1	C10H12N2O	unknown
+NC1=NCC(c2ccc3c(c2)OCO3)O1	C10H10N2O3	unknown
+COC(=O)C(c1ccccc1)C1CCCCN1	C14H19NO2	unknown
+CCOC(=O)C(c1ccccc1)C1CCCCN1	C15H21NO2	unknown
+CCNC(C)C(=O)c1ccc(CC)cc1	C13H19NO	beta-ketone
+CCNC(C)C(=O)c1ccc(C)c(C)c1	C13H19NO	beta-ketone
+CC(=O)C(N)c1ccc(F)cc1	C9H10FNO	unknown
+CCNC(C)C(=O)c1ccc(F)cc1	C11H14FNO	beta-ketone
+CCc1ccc(C(=O)C(C)N(C)C)cc1	C13H19NO	beta-ketone
+CNC(C)Cc1c2occc2c(C)c2ccoc12	C15H17NO2	unknown
+COc1cc(Cl)c(CC(C)N)c(OC)c1	C11H16ClNO2	unknown
+COc1cc(C(O)CN)c(OC)cc1Br	C10H14BrNO3	unknown
+CCc1cc(C)c(OC)cc1CC(C)N	C13H21NO	unknown
+CCc1cc(CC(C)N)c(OC)cc1C	C13H21NO	unknown
+CCC(N)C(O)c1cc(OC)c(Br)cc1OC	C12H18BrNO3	unknown
+CC(N)Cc1c2c(c(Br)c3c1OCC3)CCO2	C13H16BrNO2	unknown
+CC(N)Cc1c2c(c(Br)c3c1CCO3)OCC2	C13H16BrNO2	unknown
+CSc1c2c(c(CC(C)N)c3c1OCC3)CCO2	C14H19NO2S	unknown
+CC(N)Cc1c2occc2c(Br)c2ccoc12	C13H12BrNO2	unknown
+CC(N)Cc1c2ccoc2c(Br)c2occc12	C13H12BrNO2	unknown
+CC(N)Cc1cc(F)c(Br)cc1F	C9H10BrF2N	unknown
+Oc1ccccc1CNCCc1c2c(c(Br)c3c1OCC3)OCC2	C19H20BrNO3	unknown
+Oc1ccccc1CNCCc1c2ccoc2c(Br)c2ccoc12	C19H16BrNO3	unknown
+COc1cc(CCNC(C)c2ccccc2OC)c(OC)cc1Br	C19H24BrNO3	unknown
+COc1cc(CCNC(C)c2ccccc2OC)c(OC)cc1I	C19H24INO3	unknown
+COc1cc(CCNCc2ccccc2OC)cc(OC)c1	C18H23NO3	unknown
+COc1ccccc1CNCCc1c(OC)cccc1OC	C18H23NO3	unknown
+COc1ccccc1CNCCc1ccc(OC)c(OC)c1OC	C19H25NO4	unknown
+COc1cc(OC)c(OC)cc1CCNCc1ccccc1OC	C19H25NO4	unknown
+COc1cc(OC)c(CCNCc2ccccc2OC)c(OC)c1	C19H25NO4	unknown
+COc1ccccc1CNCCc1ccccc1Br	C16H18BrNO	unknown
+COc1ccccc1CNCCc1cccc(Br)c1	C16H18BrNO	unknown
+COc1ccc(CC(N)C(=O)O)cc1OC	C11H15NO4	unknown
+Cc1c(O)cc(CC(C)N)cc1O	C10H15NO2	unknown
+CCOc1cc(CC(N)CC)c(OCC)cc1C	C15H25NO2	unknown
+Cc1cccc2c(CCN(C)C)c[nH]c12	C13H18N2	tryptamine
+CN(C)CCc1c[nH]c2cccc(N)c12	C12H17N3	tryptamine
+CN(C)CCCc1c[nH]c2ccccc12	C13H18N2	unknown
+CN(C)CCc1c[nH]c2cc(F)ccc12	C12H15FN2	tryptamine
+CN(C)CCc1c[nH]c2cccc(F)c12	C12H15FN2	tryptamine
+CN(C)CCc1c[nH]c2ccc(F)cc12	C12H15FN2	tryptamine
+CN(C)CCc1c[nH]c2ccc(F)c(F)c12	C12H14F2N2	tryptamine
+CN(C)CCc1c[nH]c2cc(F)c(F)cc12	C12H14F2N2	tryptamine
+CN(C)CCc1c[nH]c2c(F)ccc(F)c12	C12H14F2N2	tryptamine
+C[N+](C)([O-])CCc1c[nH]c2ccccc12	C12H16N2O	tryptamine
+CN(C)CCc1cn(C)c2cccc(OP(=O)(O)O)c12	C13H19N2O4P	tryptamine
+CCCCn1cc(CCN(C)C)c2c(OP(=O)(O)O)cccc21	C16H25N2O4P	tryptamine
+Cc1[nH]c2cccc(O)c2c1CCN(C)C	C13H18N2O	tryptamine
+CC(Cc1c[nH]c2cccc(O)c12)N(C)C	C13H18N2O	tryptamine
+CN(C)CCc1c[nH]c2ccc(C=O)c(O)c12	C13H16N2O2	tryptamine
+CN(C)CCc1c[nH]c2c(C=O)ccc(O)c12	C13H16N2O2	tryptamine
+CN(C)CCc1c[nH]c2ccc(Br)c(O)c12	C12H15BrN2O	tryptamine
+CN(C)CCc1c[nH]c2c(Br)cc(Br)c(O)c12	C12H14Br2N2O	tryptamine
+Cc1ccc(C)n1CCc1c[nH]c2ccccc12	C16H18N2	tryptamine
+Oc1cccc2[nH]cc(CCN3CCc4ccccc4C3)c12	C19H20N2O	tryptamine
+CN(C)Cc1c[nH]c2cccc(O)c12	C11H14N2O	unknown
+CN(C)Cc1cn(C)c2cccc(O)c12	C12H16N2O	unknown
+CN(C)CCCc1c[nH]c2cccc(O)c12	C13H18N2O	unknown
+CN(C)CCn1ccc2c(O)cccc21	C12H16N2O	unknown
+COc1ccc2c3c1C(CN)CCC3CO2	C13H17NO2	unknown
+COc1cc(Br)c2occ3c2c1CC(N)C3	C12H12BrNO2	unknown
+COC(=O)[C@@H]1[C@H]2C[C@H]3c4[nH]c5ccccc5c4CCN3C[C@@H]2CC[C@@H]1O	C21H26N2O3	unknown
+COc1cccc2[nH]cc(CC(C)N)c12	C12H16N2O	tryptamine
+COc1ccc2c(CC(C)N)c[nH]c2c1	C12H16N2O	tryptamine
+COc1cccc2[nH]cc(C3CC3N)c12	C12H14N2O	tryptamine
+COc1ccc2[nH]cc(C3CC3N)c2c1	C12H14N2O	tryptamine
+NC1CC1c1c[nH]c2ccc(F)cc12	C11H11FN2	tryptamine
+CN1CCC(c2c[nH]c3cccc(O)c23)C1	C13H16N2O	unknown
+COc1ccc2[nH]cc(C3CCN(C)C3)c2c1	C14H18N2O	unknown
+COc1cc(OC)c2[nH]cc(CCN(C)C)c2c1	C14H20N2O2	tryptamine
+CSc1ccc2c(CCN(C)C)c[nH]c2c1	C13H18N2S	tryptamine
+NCCOc1c(Cl)cccc1-c1ccccc1	C14H14ClNO	unknown
+CC(C)NCC(O)c1cc(O)cc(O)c1	C11H17NO3	unknown
+CCC(N)c1cccc2ccccc12	C13H15N	unknown
+CC(N)Cc1ccc(N(C)C)cc1F	C11H17FN2	unknown
+Cc1cc(N(C)C)ccc1CC(C)(C)N	C13H22N2	unknown
+C#CCN(C)CCOc1ccc(Cl)cc1Cl	C12H13Cl2NO	unknown
+Cc1ccc(O)c(CCNC(C)C)c1	C12H19NO	unknown
+COc1ccc(C)c(CC(C)N)c1	C11H17NO	unknown
+COc1ccc(OC)c(N2CCNCC2)c1	C12H18N2O2	unknown
+COc1sc(SC)cc1CCN	C8H13NOS2	unknown
+NC(CF)Cc1ccc(O)c(O)c1	C9H12FNO2	unknown
+NCCc1ccc(O)c(F)c1	C8H10FNO	unknown
+Cc1cc(CCN)ccc1O	C9H13NO	unknown
+CCOc1cc(OC)c(CC(C)N)c(OC)c1	C13H21NO3	unknown
+NCCc1cc(F)c(O)c(O)c1F	C8H9F2NO2	unknown
+COc1c2c(c(OC)c(OC)c1OC)CN(C)CC2	C14H21NO4	unknown
+CCC(N)Cc1c[nH]c2cccc(C)c12	C13H18N2	tryptamine
+CC(N)Cc1c(F)cc(F)cc1F	C9H10F3N	unknown
+CCC(N)Cc1c[nH]c2c(C)cccc12	C13H18N2	tryptamine
+Cc1cccc2c(CC(C)N)c[nH]c12	C12H16N2	tryptamine
+CC#Cc1cc(OC)c(CCN)cc1OC	C13H17NO2	unknown
+C=CC(F)c1cc(OC)c(CCN)cc1OC	C13H18FNO2	unknown
+COc1cc(CCN)cc(OC)c1CC(F)(F)F	C12H16F3NO2	unknown
+COc1ccc(C)cc1CCN	C10H15NO	unknown
+C=CC(C)Oc1c(OC)cc(CCN)cc1OC	C14H21NO3	unknown
+COc1cc(CCN)cc(OC)c1OCF	C11H16FNO3	unknown
+COc1cc(C(=O)N2CCNCC2)c(OC)cc1Br	C13H17BrN2O3	unknown
+COc1cc(CCN)c(C)c(OC)c1OC	C12H19NO3	unknown
+COc1cc(CN)c(OC)cc1Br	C9H12BrNO2	unknown
+CC(C)n1cc(CCN(C)C)c2c(O)cc(F)cc21	C15H21FN2O	tryptamine
+COc1ccc2occ3c2c1C(CN)CC3	C13H15NO2	unknown
+CN1CCN(CCc2c[nH]c3ccccc23)CC1	C15H21N3	tryptamine
+CCOc1ccccc1CC(CC)NC	C13H21NO	unknown
+CCOc1cccc(CC(CC)NC)c1	C13H21NO	unknown
+CCOc1ccc(CC(CC)NC)cc1	C13H21NO	unknown
+CCCOc1cc(CC(N)CC)c(OCCC)cc1C	C17H29NO2	unknown
+CCC(N)Cc1cc(OC(C)C)c(C)cc1OC(C)C	C17H29NO2	unknown
+CCCCOc1cc(CC(N)CC)c(OCCCC)cc1C	C19H33NO2	unknown
+CCOc1cc(CC(N)CC)c(OC)cc1C	C14H23NO2	unknown
+CCOc1cc(C)c(OC)cc1CC(N)CC	C14H23NO2	unknown
+CCOc1cc(CC(N)CC)c(OCC)cc1CC	C16H27NO2	unknown
+CCCc1cc(OCC)c(CC(N)CC)cc1OCC	C17H29NO2	unknown
+CC1c2[nH]c3ccccc3c2CCN1C	C13H16N2	unknown
+COc1ccc2[nH]c3c(c2c1)CCN(C)C3	C13H16N2O	unknown
+COc1cc(CCNCc2cccc(OC)c2O)c(OC)cc1Br	C18H22BrNO4	unknown
+COc1cc(CCN)c2c(c1OC)S(=O)SS2	C10H13NO3S3	unknown
+C=CCOc1c(OC)cc(CCN)cc1SC	C13H19NO2S	unknown
+COc1ccc(OC)c(CNCCc2cc(OC)c(Br)cc2OC)c1	C19H24BrNO4	unknown
+COc1ccc(CNCCc2cc(OC)c(Br)cc2OC)c(OC)c1	C19H24BrNO4	unknown
+COc1cc(CCNCc2cccc3cc[nH]c23)c(OC)cc1Br	C19H21BrN2O2	unknown
+COc1cc(CCNCc2cccc3ccoc23)c(OC)cc1Br	C19H20BrNO3	unknown
+COc1cc(CCNCc2cccc(OC)c2F)c(OC)cc1Br	C18H21BrFNO3	unknown
+COc1cc(CCNCc2c(OC)cccc2OC)c(OC)cc1Br	C19H24BrNO4	unknown
+COc1cc(CCNCc2cccc(OC)c2OC)c(OC)cc1Br	C19H24BrNO4	unknown
+COc1cc(CCNCc2cccc3ccsc23)c(OC)cc1Br	C19H20BrNO2S	unknown
+COc1cc(CCNCc2cccc3cn[nH]c23)c(OC)cc1Br	C18H20BrN3O2	unknown
+COc1cc(CCNCc2cccc3c2OCC3)c(OC)cc1Br	C19H22BrNO3	unknown
+COc1cc(CCNCc2cccc3cnoc23)c(OC)cc1Br	C18H19BrN2O3	unknown
+COc1cc(CCNCc2cccc3nc[nH]c23)c(OC)cc1Br	C18H20BrN3O2	unknown
+COc1cc(CCNCc2cccc3ncoc23)c(OC)cc1Br	C18H19BrN2O3	unknown
+COc1cc(CCNCc2cccc3ocnc23)c(OC)cc1Br	C18H19BrN2O3	unknown
+COc1cc(CCNCc2ccccn2)c(OC)cc1Br	C16H19BrN2O2	unknown
+COc1cc(CCNCc2cccnc2)c(OC)cc1Br	C16H19BrN2O2	unknown
+COc1cc(CCNCc2ccncc2)c(OC)cc1Br	C16H19BrN2O2	unknown
+COc1cc(CCNCc2cccc[n+]2[O-])c(OC)cc1Br	C16H19BrN2O3	unknown
+COc1cc(CCNCc2cccnc2OC)c(OC)cc1Br	C17H21BrN2O3	unknown
+COc1cc(CCNCc2ccc[nH]c2=O)c(OC)cc1Br	C16H19BrN2O3	unknown
+COc1cc(CC2Cc3ccccc3CN2)c(OC)cc1Br	C18H20BrNO2	unknown
+CC1C(c2ccccc2)OCCN1C	C12H17NO	unknown
+CC(N)Cc1ccc2cc[nH]c2c1	C11H14N2	unknown
+COc1cc(C2CCCN(Cc3ccccc3OC)C2)c(OC)cc1Br	C21H26BrNO3	unknown
+COc1cc(C2CCC(c3ccccc3OC)NC2)c(OC)cc1Br	C20H24BrNO3	unknown
+COc1cc(C[C@@H]2CCC[C@@H](c3ccccc3OC)N2)c(OC)cc1Br	C21H26BrNO3	unknown
+COc1cc(CCNCc2cc(C)c(C)cc2OC)c(OC)cc1Br	C20H26BrNO3	unknown
+COc1cc(CCNCc2cc(Br)ccc2OC)c(OC)cc1Br	C18H21Br2NO3	unknown
+COc1cc(CCNCc2ccc(Br)cc2OC)c(OC)cc1Br	C18H21Br2NO3	unknown
+COc1cc(CCNCc2ccc(C)cc2OC)c(OC)cc1Br	C19H24BrNO3	unknown
+CCc1ccc(CNCCc2cc(OC)c(Br)cc2OC)c(OC)c1	C20H26BrNO3	unknown
+CCCc1ccc(CNCCc2cc(OC)c(Br)cc2OC)c(OC)c1	C21H28BrNO3	unknown
+COc1cc(CCNCc2ccc(CC(C)C)cc2OC)c(OC)cc1Br	C22H30BrNO3	unknown
+COc1cc(CCNCc2cc(CO)ccc2OC)c(OC)cc1Br	C19H24BrNO4	unknown
+COc1cc(CCNCc2cc(CCO)ccc2OC)c(OC)cc1Br	C20H26BrNO4	unknown
+CCCc1cc(OC)c(CCNCc2ccccc2OC)cc1OC	C21H29NO3	unknown
+COc1cc(SC)c(OC)cc1CCNCc1ccccc1OC	C19H25NO3S	unknown
+CCSc1cc(OC)c(CCNCc2ccccc2OC)cc1OC	C20H27NO3S	unknown
+CCCSc1cc(OC)c(CCNCc2ccccc2OC)cc1OC	C21H29NO3S	unknown
+COc1cc(CCNCc2ccccc2O)c(OC)cc1Cl	C17H20ClNO3	unknown
+COc1cc(CCNCc2ccccc2O)c(OC)cc1F	C17H20FNO3	unknown
+COc1cc(CCNCc2ccccc2O)c(OC)cc1C	C18H23NO3	unknown
+CCc1cc(OC)c(CCNCc2ccccc2O)cc1OC	C19H25NO3	unknown
+CCCc1cc(OC)c(CCNCc2ccccc2O)cc1OC	C20H27NO3	unknown
+COc1cc(SC)c(OC)cc1CCNCc1ccccc1O	C18H23NO3S	unknown
+CCSc1cc(OC)c(CCNCc2ccccc2O)cc1OC	C19H25NO3S	unknown
+COc1cc(CCNCc2ccccc2O)c(OC)cc1C#N	C18H20N2O3	unknown
+COc1cc(CCNCc2ccccc2F)c(OC)cc1Br	C17H19BrFNO2	unknown
+COc1cc(CCNCc2ccccc2F)c(OC)cc1Cl	C17H19ClFNO2	unknown
+COc1cc(CCNCc2ccccc2F)c(OC)cc1C	C18H22FNO2	unknown
+CCc1cc(OC)c(CCNCc2ccccc2F)cc1OC	C19H24FNO2	unknown
+CCCc1cc(OC)c(CCNCc2ccccc2F)cc1OC	C20H26FNO2	unknown
+COc1cc(SC)c(OC)cc1CCNCc1ccccc1F	C18H22FNO2S	unknown
+CCSc1cc(OC)c(CCNCc2ccccc2F)cc1OC	C19H24FNO2S	unknown
+CCCSc1cc(OC)c(CCNCc2ccccc2F)cc1OC	C20H26FNO2S	unknown
+COc1cc(C(F)(F)F)c(OC)cc1CCNCc1ccccc1F	C18H19F4NO2	unknown
+COc1cc(CCNCc2ccccc2F)c(OC)cc1C#N	C18H19FN2O2	unknown
+COc1cc(CCNCc2cccc3c2OCO3)c(OC)cc1Cl	C18H20ClNO4	unknown
+COc1cc(CCNCc2cccc3c2OCO3)c(OC)cc1F	C18H20FNO4	unknown
+COc1cc(CCNCc2cccc3c2OCO3)c(OC)cc1C	C19H23NO4	unknown
+CCc1cc(OC)c(CCNCc2cccc3c2OCO3)cc1OC	C20H25NO4	unknown
+CCCc1cc(OC)c(CCNCc2cccc3c2OCO3)cc1OC	C21H27NO4	unknown
+COc1cc(SC)c(OC)cc1CCNCc1cccc2c1OCO2	C19H23NO4S	unknown
+CCSc1cc(OC)c(CCNCc2cccc3c2OCO3)cc1OC	C20H25NO4S	unknown
+CCCSc1cc(OC)c(CCNCc2cccc3c2OCO3)cc1OC	C21H27NO4S	unknown
+COc1cc(C(F)(F)F)c(OC)cc1CCNCc1cccc2c1OCO2	C19H20F3NO4	unknown
+COc1cc(CCNCc2cccc3c2OCO3)c(OC)cc1C#N	C19H20N2O4	unknown
+CC(N)Cc1cccc2cc[nH]c12	C11H14N2	unknown
+CCCCN(CCC)C1CCc2cc(O)c(O)cc2C1	C17H27NO2	unknown
+CN(C)C1CCc2c(ccc(O)c2O)C1	C12H17NO2	unknown
+CC(=O)Cc1ccccc1	C9H10O	unknown
+COc1cccc(CC(C)=O)c1OC	C11H14O3	unknown
+COc1ccc(CC(C)=O)cc1OC	C11H14O3	unknown
+COc1ccc(CC(C)=O)cc1	C10H12O2	unknown
+C=CCc1ccccc1	C9H10	unknown
+C=CCc1ccccc1OC	C10H12O	unknown
+C=CCc1ccc(CCCCC)cc1O	C14H20O	unknown
+C=CCc1c(O)cc(C)cc1OC	C11H14O2	unknown
+C=CCc1ccc(C(C)CCCC)cc1O	C15H22O	unknown
+C=CCc1cc(OC)ccc1OC	C11H14O2	unknown
+C=CCc1cc(OC)ccc1O	C10H12O2	unknown
+C=CCc1c(C)cc(OC)cc1O	C11H14O2	unknown
+C=CCc1c(O)cccc1OC	C10H12O2	unknown
+C=CCc1cccc(OC)c1O	C10H12O2	unknown
+C=CCc1c(O)cccc1C(C)CCCC	C15H22O	unknown
+C=CCc1ccccc1O	C9H10O	unknown
+C=CCc1ccc(OC)cc1O	C10H12O2	unknown
+C=CCc1c(O)cccc1CCCCC	C14H20O	unknown
+CNC1CCc2c(OC)ccc(OC)c2C1	C13H19NO2	unknown
+COc1ccc(OC)c2c1CCC(N(C)C)C2	C14H21NO2	unknown
+CCCNC1CCc2cc(O)c(O)cc2C1	C13H19NO2	unknown
+NC1CCc2cc(O)c(O)cc2C1	C10H13NO2	unknown
+CCNC1CCc2cc(O)c(O)cc2C1	C12H17NO2	unknown
+C#CCN(C)Cc1ccccc1	C11H13N	unknown
+NCC1c2ccccc2Cc2ccccc21	C15H15N	unknown
+CCCC(C(=O)c1ccc(C)s1)N1CCCC1	C14H21NOS	unknown
+CCCC(C(=O)c1ccc(C)s1)N1CCCCC1	C15H23NOS	unknown
+CCCC(C(=O)c1ccc(C)s1)N1CCOCC1	C14H21NO2S	unknown
+CCCC(C(=O)c1ccc(C)s1)N1CCN(C)CC1	C15H24N2OS	unknown
+CCCC(C(=O)c1ccc(Cl)s1)N1CCCC1	C13H18ClNOS	unknown
+CCCC(C(=O)c1ccc(Cl)s1)N1CCCCC1	C14H20ClNOS	unknown
+CCCC(C(=O)c1ccc(Cl)s1)N1CCCCC1C	C15H22ClNOS	unknown
+CCCC(C(=O)c1ccc(Cl)s1)N1CCN(C)CC1	C14H21ClN2OS	unknown
+CCCC(C(=O)c1ccc(CC)s1)N1CCCC1	C15H23NOS	unknown
+CCCC(C(=O)c1ccc(CC)s1)N1CCCCC1	C16H25NOS	unknown
+CCCC(C(=O)c1ccc(Cl)s1)N1CCOCC1	C13H18ClNO2S	unknown
+CCCC(C(=O)c1ccc(Cl)s1)N1CC(C)OC(C)C1	C15H22ClNO2S	unknown
+CCCC(C(=O)c1ccc(Cl)s1)N1CCCCCC1	C15H22ClNOS	unknown
+CCCCCN1CCN(C(CCC)C(=O)c2ccc(Cl)s2)CC1	C18H29ClN2OS	unknown
+NC1CCCc2ccccc2C1	C11H15N	unknown
+CC(C)NC1CCCc2ccccc2C1	C14H21N	unknown
+CN(C)C1CCCc2ccccc2C1	C13H19N	unknown
+COc1cc(CC2CCCCN2)cc(OC)c1OC	C15H23NO3	unknown
+COc1cc(C2CCCNC2)cc(OC)c1OC	C14H21NO3	unknown
+COc1cc(C2CNCCO2)cc(OC)c1OC	C13H19NO4	unknown
+Oc1cc2c(cc1O)CCNCC2	C10H13NO2	unknown
+Oc1cc2c(cc1O)C1c3ccccc3CCC1NCC2	C18H19NO2	unknown
+Oc1cc2c(cc1O)C1c3ccccc3OCC1NCC2	C17H17NO3	unknown
+Oc1cc2c(cc1O)C1c3ccccc3SCC1NCC2	C17H17NO2S	unknown
+CNC1CCc2ccccc2C1	C11H15N	unknown
+CCNC1CCc2ccccc2C1	C12H17N	unknown
+CCCNC1CCc2ccccc2C1	C13H19N	unknown
+CC(C)NC1CCc2ccccc2C1	C13H19N	unknown
+CCCCNC1CCc2ccccc2C1	C14H21N	unknown
+CN(C)C1CCc2ccccc2C1	C12H17N	unknown
+CCN(CC)C1CCc2ccccc2C1	C14H21N	unknown
+CCCN(CCC)C1CCc2ccccc2C1	C16H25N	unknown
+CCCCN(CCCC)C1CCc2ccccc2C1	C18H29N	unknown
+CC(C)N(C)C1CCc2ccccc2C1	C14H21N	unknown
+CNC1Cc2ccccc2C1	C10H13N	unknown
+CCNC1Cc2ccccc2C1	C11H15N	unknown
+CCCNC1Cc2ccccc2C1	C12H17N	unknown
+CC(C)NC1Cc2ccccc2C1	C12H17N	unknown
+CCCCNC1Cc2ccccc2C1	C13H19N	unknown
+CN(C)C1Cc2ccccc2C1	C11H15N	unknown
+CCN(CC)C1Cc2ccccc2C1	C13H19N	unknown
+CCCN(CCC)C1Cc2ccccc2C1	C15H23N	unknown
+CCCCN(CCCC)C1Cc2ccccc2C1	C17H27N	unknown
+CC(C)N(C)C1Cc2ccccc2C1	C13H19N	unknown
+Oc1ccc2c(c1O)CCC1CCNCC21	C13H17NO2	unknown
+Oc1ccc2c(c1O)CC(c1ccccc1)C1CCNCC21	C19H21NO2	unknown
+CC(O)Cc1ccccc1	C9H12O	unknown
+COc1cccc(CC(C)O)c1OC	C11H16O3	unknown
+COc1ccc(CC(C)O)cc1OC	C11H16O3	unknown
+COc1ccc(CC(C)O)cc1	C10H14O2	unknown
+CNC(C)Cc1ccsc1	C8H13NS	unknown
+CN1CCc2cc(O)ccc2C1	C10H13NO	unknown
+COc1ccc2c(c1)CCNC2	C10H13NO	unknown
+COc1ccc2c(c1)CN(C)CC2	C11H15NO	unknown
+CC1NCCc2ccccc21	C10H13N	unknown
+CN1CCc2cccc(O)c2C1	C10H13NO	unknown
+CN1CCc2c(O)ccc(O)c2C1	C10H13NO2	unknown
+COc1cc(O)cc2c1CCN(C)C2	C11H15NO2	unknown
+COc1cc2c(cc1O)CCNC2C	C11H15NO2	unknown
+COc1ccc2cc3[n+](cc2c1OC)CCc1cc2c(cc1-3)OCO2	C20H18NO4	unknown
+COc1cc2c(cc1OC)C(C)NCC2	C12H17NO2	unknown
+COc1cc2c(cc1OC)CCN=C2	C11H13NO2	unknown
+CC1NCCc2cc3c(cc21)OCO3	C11H13NO2	unknown
+O=CNCCc1ccc2c(c1)OCO2	C10H11NO3	unknown
+c1c2c(cc3c1OCO3)CNCC2	C10H11NO2	unknown
+CN1CCc2cc3c(cc2C1)OCO3	C11H13NO2	unknown
+COc1cc2c(cc1OC)CC[N+](C)=C2	C12H16NO2	unknown
+COc1cc2c(cc1OC)CN(C)CC2	C12H17NO2	unknown
+COc1cc2c(cc1OC)C(C)=NCC2	C12H15NO2	unknown
+COc1cc2c(cc1OC)C(C)=[N+](C)CC2	C13H18NO2	unknown
+COc1cc(C)c(OC)c2c1CCNC2	C12H17NO2	unknown
+COc1cc(C)c(OC)c2c1CCN(C)C2	C13H19NO2	unknown
+COc1cc(Br)c(OC)c2c1CCNC2	C11H14BrNO2	unknown
+COc1ccc2c(c1)CNCC2	C10H13NO	unknown
+c1ccc2c(c1)CCNC2	C9H11N	unknown
+CN1CCc2ccccc2C1	C10H13N	unknown
+CCCCNC1CCc2cc(O)c(O)cc2C1	C14H21NO2	unknown
+CCCN(CCC)C1CCc2cc(O)c(O)cc2C1	C16H25NO2	unknown
+CC[C@@H]1CN2CCc3c([nH]c4cccc(OC)c34)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC	C23H30N2O4	unknown
+COc1cccc2c1c(CCN(C)C)cn2S(=O)(=O)C1CCCCC1	C19H28N2O3S	tryptamine
+COc1cccc2c1c(CCN(C)C)cn2S(=O)(=O)c1ccccc1	C19H22N2O3S	tryptamine
+COc1cccc2c1c(CCN(C)C)cn2S(=O)(=O)c1ccc(C)cc1	C20H24N2O3S	tryptamine
+COc1cccc2c1c(CCN(C)C)cn2S(=O)(=O)c1ccc(N)cc1	C19H23N3O3S	tryptamine
+COc1cccc2c1c(CCN(C)C)cn2Sc1ccc(C)cc1	C20H24N2OS	tryptamine
+COc1cccc2c1c(CCN(C)C)cn2Sc1ccc(C(F)(F)F)cc1	C20H21F3N2OS	tryptamine
+COc1cccc2c1c(CCN(C)C)cn2Sc1ccc(Cl)cc1	C19H21ClN2OS	tryptamine
+COc1cccc2c1c(CCN(C)C)cn2Sc1ccc(N)cc1	C19H23N3OS	tryptamine
+COc1ccc2c(c1)c1c(n2Cc2ccccc2)CCCC1CN(C)C	C23H28N2O	unknown
+COc1ccc2c(c1)c1c(n2S(=O)(=O)c2ccccc2)CCCC1CN(C)C	C22H26N2O3S	unknown
+CCC(C)N(C)CCc1c[nH]c2ccccc12	C15H22N2	tryptamine
+CCC(C)N(CCc1c[nH]c2ccccc12)C(C)CC	C18H28N2	tryptamine
+O=CNCCc1c[nH]c2ccccc12	C11H12N2O	tryptamine
+CCOc1ccc2[nH]cc(CCN)c2c1	C12H16N2O	tryptamine
+CN(C)CCc1csc2cccc(O)c12	C12H15NOS	unknown
+COc1cccc2scc(CCN(C)C)c12	C13H17NOS	unknown
+CNCCc1csc2cccc(OC)c12	C12H15NOS	unknown
+COc1cccc2scc(CCN)c12	C11H13NOS	unknown
+CN(C)CCc1c[nH]c2cccc(Cl)c12	C12H15ClN2	tryptamine
+CN(C)CCc1c[nH]c2cccc([N+](=O)[O-])c12	C12H15N3O2	tryptamine
+NCCc1c[nH]c2cccc([N+](=O)[O-])c12	C10H11N3O2	tryptamine
+NCCc1c[nH]c2cccc(N)c12	C10H13N3	tryptamine
+CN(C)CCc1c[nH]c2cc([N+](=O)[O-])ccc12	C12H15N3O2	tryptamine
+NCCc1c[nH]c2cc([N+](=O)[O-])ccc12	C10H11N3O2	tryptamine
+O=C(O)CCNCCc1c[nH]c2cccc([N+](=O)[O-])c12	C13H15N3O4	tryptamine
+CCN(CC)C(=O)CCN(C)CCc1c[nH]c2cc([N+](=O)[O-])ccc12	C18H26N4O3	tryptamine
+CCN(CC)C(=O)CCN(C)CCc1c[nH]c2cccc([N+](=O)[O-])c12	C18H26N4O3	tryptamine
+CN(C)CCc1c[nH]c2cc(N)ccc12	C12H17N3	tryptamine
+NCCc1c[nH]c2cc(N)ccc12	C10H13N3	tryptamine
+COc1cccc2c1c(CCN(C)C)cn2S(=O)(=O)C(C)C	C16H24N2O3S	tryptamine
+CCCS(=O)(=O)n1cc(CCN(C)C)c2c(OC)cccc21	C16H24N2O3S	tryptamine
+CCCCCS(=O)(=O)n1cc(CCN(C)C)c2c(OC)cccc21	C18H28N2O3S	tryptamine
+CCCCCCCCS(=O)(=O)n1cc(CCN(C)C)c2c(OC)cccc21	C21H34N2O3S	tryptamine
+COc1ccc2[nH]cc3c2c1[C@H]1CCCN[C@@H]1C3	C15H18N2O	unknown
+COc1ccc2[nH]cc3c2c1[C@H]1CCCN(C)[C@@H]1C3	C16H20N2O	unknown
+CCCN1CCC[C@@H]2c3c(OC)ccc4[nH]cc(c34)C[C@H]21	C18H24N2O	unknown
+Oc1cc2c3c(c[nH]c3c1)C[C@H]1NCc3ccccc3[C@H]21	C18H16N2O	unknown
+CN1Cc2ccccc2[C@@H]2c3cc(O)cc4[nH]cc(c34)C[C@H]21	C19H18N2O	unknown
+CCCN1Cc2ccccc2[C@@H]2c3cc(O)cc4[nH]cc(c34)C[C@H]21	C21H22N2O	unknown
+CN1CCC=C2c3cc(O)cc4[nH]cc(c34)C[C@H]21	C15H16N2O	unknown
+COc1cc(CCN)cc(OC)c1OCCC(F)F	C13H19F2NO3	unknown
+COc1cc(CCN)cc(OC)c1OC1CC1	C13H19NO3	unknown
+NCCc1cc(N)ccc1N	C8H13N3	unknown
+CC(C)NCCc1cc(Cl)ccc1O	C11H16ClNO	unknown
+Cc1ccc(S)c(CCN)c1	C9H13NS	unknown
+NCCc1cc(O)ccc1S	C8H11NOS	unknown
+NCC(O)c1cc(O)ccc1S	C8H11NO2S	unknown
+Nc1ccc(N)c(CCNCc2ccccc2)c1	C15H19N3	unknown
+CN(CCc1c[nH]c2ccccc12)Cc1ccccc1	C18H20N2	tryptamine
+CN(CCc1c[nH]c2ccccc12)Cc1ccc(Br)cc1	C18H19BrN2	tryptamine
+CN(CCc1ccccc1)CCc1c[nH]c2ccccc12	C19H22N2	tryptamine
+Cc1ccccc1CCN(C)CCc1c[nH]c2ccccc12	C20H24N2	tryptamine
+CN(CCc1ccccc1F)CCc1c[nH]c2ccccc12	C19H21FN2	tryptamine
+CN(CCc1ccccc1Cl)CCc1c[nH]c2ccccc12	C19H21ClN2	tryptamine
+Cc1ccc(C)c(CCN(C)CCc2c[nH]c3ccccc23)c1	C21H26N2	tryptamine
+COc1ccccc1CCN(C)CCc1c[nH]c2ccccc12	C20H24N2O	tryptamine
+COc1ccc(OC)c(CCN(C)CCc2c[nH]c3ccccc23)c1	C21H26N2O2	tryptamine
+CN(CCc1c(Cl)cccc1Cl)CCc1c[nH]c2ccccc12	C19H20Cl2N2	tryptamine
+Cc1cccc(CCN(C)CCc2c[nH]c3ccccc23)c1	C20H24N2	tryptamine
+CC(=O)Oc1cccc(CCN(C)CCc2c[nH]c3ccccc23)c1	C21H24N2O2	tryptamine
+COc1cccc(CCN(C)CCc2c[nH]c3ccccc23)c1	C20H24N2O	tryptamine
+CN(CCc1cccc(Cl)c1)CCc1c[nH]c2ccccc12	C19H21ClN2	tryptamine
+CN(CCc1cccc(Br)c1)CCc1c[nH]c2ccccc12	C19H21BrN2	tryptamine
+Cc1cc(C)cc(CCN(C)CCc2c[nH]c3ccccc23)c1	C21H26N2	tryptamine
+COc1ccc(CCN(C)CCc2c[nH]c3ccccc23)cc1OC	C21H26N2O2	tryptamine
+CN(CCc1ccc(Cl)c(Cl)c1)CCc1c[nH]c2ccccc12	C19H20Cl2N2	tryptamine
+Cc1ccc(CCN(C)CCc2c[nH]c3ccccc23)cc1	C20H24N2	tryptamine
+COc1ccc(CCN(C)CCc2c[nH]c3ccccc23)cc1	C20H24N2O	tryptamine
+CN(CCc1ccc(F)cc1)CCc1c[nH]c2ccccc12	C19H21FN2	tryptamine
+CN(CCc1ccc(Cl)cc1)CCc1c[nH]c2ccccc12	C19H21ClN2	tryptamine
+CN(CCc1ccc(Br)cc1)CCc1c[nH]c2ccccc12	C19H21BrN2	tryptamine
+CN(CCc1ccc([N+](=O)[O-])cc1)CCc1c[nH]c2ccccc12	C19H21N3O2	tryptamine
+CN(CCc1ccc(-c2ccccc2)cc1)CCc1c[nH]c2ccccc12	C25H26N2	tryptamine
+CN(CCc1c[nH]c2ccccc12)CCc1c[nH]c2ccccc12	C21H23N3	tryptamine
+COc1ccc2[nH]cc(CCN(C)CCc3c[nH]c4ccccc34)c2c1	C22H25N3O	tryptamine
+CN(CCc1cccc2ccccc12)CCc1c[nH]c2ccccc12	C23H24N2	tryptamine
+CN(CCc1ccc2ccccc2c1)CCc1c[nH]c2ccccc12	C23H24N2	tryptamine
+CN(CCCc1ccccc1)CCc1c[nH]c2ccccc12	C20H24N2	tryptamine
+COc1cc(CCCN(C)CCc2c[nH]c3ccccc23)cc(OC)c1OC	C23H30N2O3	tryptamine
+CN(CCCCc1ccccc1)CCc1c[nH]c2ccccc12	C21H26N2	tryptamine
+CN(CCCSc1ccccc1)CCc1c[nH]c2ccccc12	C20H24N2S	tryptamine
+CCCCCN(C)CCc1c[nH]c2ccccc12	C16H24N2	tryptamine
+CCCCCCN(C)CCc1c[nH]c2ccccc12	C17H26N2	tryptamine
+CCCCCCCN(C)CCc1c[nH]c2ccccc12	C18H28N2	tryptamine
+CCCCCCCCN(C)CCc1c[nH]c2ccccc12	C19H30N2	tryptamine
+CCCCCCCCCCCCN(C)CCc1c[nH]c2ccccc12	C23H38N2	tryptamine
+CCCCCCCCCCCCCCN(C)CCc1c[nH]c2ccccc12	C25H42N2	tryptamine
+CCCCCCCCCCCCCCCCCCN(C)CCc1c[nH]c2ccccc12	C29H50N2	tryptamine
+CN(CCc1c[nH]c2ccccc12)CC1CC1	C15H20N2	tryptamine
+CN(CCc1c[nH]c2ccccc12)CC1CCCC1	C17H24N2	tryptamine
+CN(CCc1c[nH]c2ccccc12)CC1CCCCC1	C18H26N2	tryptamine
+CC(=O)NC(C)Cc1ccccc1O	C11H15NO2	unknown
+CCC(CC)CN(C)CCc1c[nH]c2ccccc12	C17H26N2	tryptamine
+C=CCN(C)CCc1c[nH]c2ccccc12	C14H18N2	tryptamine
+C#CCN(C)CCc1c[nH]c2ccccc12	C14H16N2	tryptamine
+CN(CCCC1CCCCC1)CCc1c[nH]c2ccccc12	C20H30N2	tryptamine
+COC(=O)CN(C)CCc1c[nH]c2ccccc12	C14H18N2O2	tryptamine
+CN(CCc1c[nH]c2ccccc12)CC(=O)OC(C)(C)C	C17H24N2O2	tryptamine
+CN(CCc1c[nH]c2ccccc12)CC(N)=O	C13H17N3O	tryptamine
+CC(=O)OCCN(C)CCc1c[nH]c2ccccc12	C15H20N2O2	tryptamine
+COc1ccc2[nH]cc(CCN(C)CCN(C)CCc3c[nH]c4ccc(OC)cc34)c2c1	C26H34N4O2	tryptamine
+COc1ccc2[nH]cc(CC[N+](C)(C)[O-])c2c1	C13H18N2O2	tryptamine
+COc1ccc2[nH]cc(CCN(C)Cc3ccccc3)c2c1	C19H22N2O	tryptamine
+COc1ccc2[nH]cc(CCN(C)Cc3ccc(Br)cc3)c2c1	C19H21BrN2O	tryptamine
+COc1ccc2[nH]cc(CCN(C)CCc3ccccc3)c2c1	C20H24N2O	tryptamine
+COc1ccc2[nH]cc(CCN(C)CCc3ccccc3C)c2c1	C21H26N2O	tryptamine
+COc1ccc2[nH]cc(CCN(C)CCc3ccccc3F)c2c1	C20H23FN2O	tryptamine
+COc1ccc2[nH]cc(CCN(C)CCc3ccccc3Cl)c2c1	C20H23ClN2O	tryptamine
+COc1ccc2[nH]cc(CCN(C)CCc3cc(C)ccc3C)c2c1	C22H28N2O	tryptamine
+COc1ccc2[nH]cc(CCN(C)CCc3ccccc3OC)c2c1	C21H26N2O2	tryptamine
+COc1ccc2[nH]cc(CCN(C)CCc3cccc(C)c3)c2c1	C21H26N2O	tryptamine
+COc1ccc2[nH]cc(CCN(C)CCc3cccc(Cl)c3)c2c1	C20H23ClN2O	tryptamine
+COc1ccc2[nH]cc(CCN(C)CCc3cccc(Br)c3)c2c1	C20H23BrN2O	tryptamine
+COc1ccc2[nH]cc(CCN(C)CCc3cc(C)cc(C)c3)c2c1	C22H28N2O	tryptamine
+COc1ccc2[nH]cc(CCN(C)CCc3ccc(OC)c(OC)c3)c2c1	C22H28N2O3	tryptamine
+COc1ccc2[nH]cc(CCN(C)CCc3ccc(Cl)c(Cl)c3)c2c1	C20H22Cl2N2O	tryptamine
+COc1ccc2[nH]cc(CCN(C)CCc3ccc(C)cc3)c2c1	C21H26N2O	tryptamine
+COc1ccc(CCN(C)CCc2c[nH]c3ccc(OC)cc23)cc1	C21H26N2O2	tryptamine
+COc1ccc2[nH]cc(CCN(C)CCc3ccc(F)cc3)c2c1	C20H23FN2O	tryptamine
+COc1ccc2[nH]cc(CCN(C)CCc3ccc(Br)cc3)c2c1	C20H23BrN2O	tryptamine
+COc1ccc2[nH]cc(CCN(C)CCc3ccc([N+](=O)[O-])cc3)c2c1	C20H23N3O3	tryptamine
+COc1ccc2[nH]cc(CCN(C)CCc3ccc(-c4ccccc4)cc3)c2c1	C26H28N2O	tryptamine
+COc1ccc2[nH]cc(CCN(C)CCc3c[nH]c4ccc(OC)cc34)c2c1	C23H27N3O2	tryptamine
+COc1ccc2[nH]cc(CCN(C)CCc3cccc4ccccc34)c2c1	C24H26N2O	tryptamine
+COc1ccc2[nH]cc(CCN(C)CCc3ccc4ccccc4c3)c2c1	C24H26N2O	tryptamine
+COc1ccc2[nH]cc(CCN(C)CCCc3ccccc3)c2c1	C21H26N2O	tryptamine
+COc1ccc2[nH]cc(CCN(C)CCCCc3ccccc3)c2c1	C22H28N2O	tryptamine
+COc1ccc2[nH]cc(CCN(C)CCCSc3ccccc3)c2c1	C21H26N2OS	tryptamine
+CCCCN(C)CCc1c[nH]c2ccc(OC)cc12	C16H24N2O	tryptamine
+CCCCCN(C)CCc1c[nH]c2ccc(OC)cc12	C17H26N2O	tryptamine
+CCCCCCCCN(C)CCc1c[nH]c2ccc(OC)cc12	C20H32N2O	tryptamine
+CCCCCCCCCCCCN(C)CCc1c[nH]c2ccc(OC)cc12	C24H40N2O	tryptamine
+CCCCCCCCCCCCCCN(C)CCc1c[nH]c2ccc(OC)cc12	C26H44N2O	tryptamine
+CCCCCCCCCCCCCCCCCCN(C)CCc1c[nH]c2ccc(OC)cc12	C30H52N2O	tryptamine
+COc1ccc2[nH]cc(CCN(C)CC3CCCC3)c2c1	C18H26N2O	tryptamine
+COc1ccc2[nH]cc(CCN(C)CC3CCCCC3)c2c1	C19H28N2O	tryptamine
+COc1ccccc1CC(C)NC(C)=O	C12H17NO2	unknown
+CCC(CC)CN(C)CCc1c[nH]c2ccc(OC)cc12	C18H28N2O	tryptamine
+C=CCN(C)CCc1c[nH]c2ccc(OC)cc12	C15H20N2O	tryptamine
+C#CCN(C)CCc1c[nH]c2ccc(OC)cc12	C15H18N2O	tryptamine
+COc1ccc2[nH]cc(CCN(C)CCCC3CCCCC3)c2c1	C21H32N2O	tryptamine
+COc1ccc2[nH]cc(CCN(C)C/C=C/c3ccccc3)c2c1	C21H24N2O	tryptamine
+COC(=O)CN(C)CCc1c[nH]c2ccc(OC)cc12	C15H20N2O3	tryptamine
+COc1ccc2[nH]cc(CCN(C)CC(=O)OC(C)(C)C)c2c1	C18H26N2O3	tryptamine
+CC(N)Cc1c2c(c(Br)c3c1OCCC3)OCC2	C14H18BrNO2	unknown
+CN(C)C(=O)N[C@H]1CC[C@H](CCN2CCN3c4cccc5[nH]cc(c45)CC3C2)CC1	C24H35N5O	unknown
+O=c1ccc2ccc(OCCCCN3CCN4c5cccc6[nH]cc(c56)CC4C3)cc2[nH]1	C26H28N4O2	unknown
+O=C1CCc2ccc(OCCCCN3CCN4c5cccc6[nH]cc(c56)CC4C3)cc2N1	C26H30N4O2	unknown
+CN(C)C(=O)N[C@H]1CC[C@H](CCN2CCN(c3cccc(Cl)c3Cl)CC2)CC1	C21H32Cl2N4O	unknown
+OCCCNCC(O)c1ccc(O)c(O)c1	C11H17NO4	unknown
+CC(CCO)NCC(O)c1ccc(O)c(O)c1	C12H19NO4	unknown
+CC(CCCO)NCC(O)c1ccc(O)c(O)c1	C13H21NO4	unknown
+CC(CCCCO)NCC(O)c1ccc(O)c(O)c1	C14H23NO4	unknown
+Cc1ccc(NC(=O)OCCCCC(C)NCC(O)c2ccc(O)c(O)c2)cc1	C22H30N2O5	unknown
+Cc1ccc(NC(=O)OCCCC(C)NCC(O)c2ccc(O)c(O)c2)cc1	C21H28N2O5	unknown
+CC(CCCOC(=O)NC1CCCCC1)NCC(O)c1ccc(O)c(O)c1	C20H32N2O5	unknown
+CCCCNC(=O)OCCCC(C)NCC(O)c1ccc(O)c(O)c1	C18H30N2O5	unknown
+Cc1ccc(C(=O)NC(=O)OCCCC(C)NCC(O)c2ccc(O)c(O)c2)cc1	C22H28N2O6	unknown
+Cc1ccc(S(=O)(=O)NC(=O)OCCCC(C)NCC(O)c2ccc(O)c(O)c2)cc1	C21H28N2O7S	unknown
+Cc1ccc(C(=O)OCCCC(C)NCC(O)c2ccc(O)c(O)c2)cc1	C21H27NO5	unknown
+NCCCNCC(O)c1ccc(O)c(O)c1	C11H18N2O3	unknown
+O=C(NCCCNCC(O)c1ccc(O)c(O)c1)Nc1ccccc1	C18H23N3O4	unknown
+CC(=O)NCCCNCC(O)c1ccc(O)c(O)c1	C13H20N2O4	unknown
+CC(=O)NCC(=O)NCCCNCC(O)c1ccc(O)c(O)c1	C15H23N3O5	unknown
+CC(CCN)NCC(O)c1ccc(O)c(O)c1	C12H20N2O3	unknown
+CC(CCCN)NCC(O)c1ccc(O)c(O)c1	C13H22N2O3	unknown
+CC(CCCCN)NCC(O)c1ccc(O)c(O)c1	C14H24N2O3	unknown
+CC(CCCCCN)NCC(O)c1ccc(O)c(O)c1	C15H26N2O3	unknown
+CC(CCNC(=O)OCc1ccccc1)NCC(O)c1ccc(O)c(O)c1	C20H26N2O5	unknown
+CC(CCCNC(=O)OCc1ccccc1)NCC(O)c1ccc(O)c(O)c1	C21H28N2O5	unknown
+CC(CCCCNC(=O)OCc1ccccc1)NCC(O)c1ccc(O)c(O)c1	C22H30N2O5	unknown
+CC(CCCCCNC(=O)OCc1ccccc1)NCC(O)c1ccc(O)c(O)c1	C23H32N2O5	unknown
+CC(CCCNC(=O)OC1CCCCC1)NCC(O)c1ccc(O)c(O)c1	C20H32N2O5	unknown
+Oc1cc2c(cc1O)[C@H]1C[C@@H](c3ccccc3)CN[C@@H]1CC2	C19H21NO2	unknown
+Oc1ccc([C@H]2CN[C@@H]3CCc4cc(O)c(O)cc4[C@H]3C2)cc1	C19H21NO3	unknown
+Oc1cccc([C@H]2CN[C@@H]3CCc4cc(O)c(O)cc4[C@H]3C2)c1	C19H21NO3	unknown
+Cc1ccc([C@H]2CN[C@@H]3CCc4cc(O)c(O)cc4[C@H]3C2)cc1	C20H23NO2	unknown
+Oc1cc2c(cc1O)[C@H]1C[C@@H](c3ccc(C(F)(F)F)cc3)CN[C@@H]1CC2	C20H20F3NO2	unknown
+CCCN1C[C@H](c2ccc(O)cc2)C[C@@H]2c3cc(O)c(O)cc3CC[C@H]21	C22H27NO3	unknown
+Cc1ccc2c(c1)[C@@H]1c3cc(O)c(O)cc3OC[C@H]1NC2	C17H17NO3	unknown
+CCc1ccc2c(c1)[C@@H]1c3cc(O)c(O)cc3OC[C@H]1NC2	C18H19NO3	unknown
+Oc1cc2c(cc1O)[C@H]1c3cc(F)ccc3CN[C@@H]1CO2	C16H14FNO3	unknown
+Oc1cc2c(cc1O)[C@H]1c3cc(C(F)(F)F)ccc3CN[C@@H]1CO2	C17H14F3NO3	unknown
+Oc1cc2c(cc1O)[C@H]1c3ccccc3CN[C@@H]1CS2	C16H15NO2S	unknown
+CCCC(C(=O)c1ccc(F)cc1)N1CCCC1	C15H20FNO	beta-ketone
+CCCC(C(=O)c1ccc(Br)cc1)N1CCCC1	C15H20BrNO	beta-ketone
+CCCC(C(=O)c1ccc(I)cc1)N1CCCC1	C15H20INO	beta-ketone
+CCCC(C(=O)c1cccc(I)c1)N1CCCC1	C15H20INO	beta-ketone
+CCCC(C(=O)c1ccc(C#N)cc1)N1CCCC1	C16H20N2O	beta-ketone
+CCCC(C(=O)c1ccc(CO)cc1)N1CCCC1	C16H23NO2	beta-ketone
+CCCC(C(=O)c1ccc([N+](=O)[O-])cc1)N1CCCC1	C15H20N2O3	beta-ketone
+CCCC(C(=O)c1ccc(OC)cc1)N1CCCC1	C16H23NO2	beta-ketone
+CCCC(C(=O)c1ccc(C(=O)OC)cc1)N1CCCC1	C17H23NO3	beta-ketone
+CCCC(C(=O)c1ccc(NC(C)=O)cc1)N1CCCC1	C17H24N2O2	beta-ketone
+CCCC(C(=O)c1ccc(C(F)(F)F)cc1)N1CCCC1	C16H20F3NO	beta-ketone
+CC#Cc1ccc(C(=O)C(CCC)N2CCCC2)cc1	C18H23NO	beta-ketone
+CCCC(C(=O)c1ccccc1C)N1CCCC1	C16H23NO	beta-ketone
+CCCC(C(=O)c1cccc(C)c1)N1CCCC1	C16H23NO	beta-ketone
+CCCC(C(=O)c1ccc(O)cc1)N1CCCC1	C15H21NO2	beta-ketone
+CCCC(C(=O)c1ccc(Cl)c(Cl)c1)N1CCCC1	C15H19Cl2NO	beta-ketone
+CCCC(C(=O)c1ccc(O)c(O)c1)N1CCCC1	C15H21NO3	beta-ketone
+CCCC(C(=O)c1ccc(OC)c(OC)c1)N1CCCC1	C17H25NO3	beta-ketone
+CCCC(C(=O)c1ccc(-c2ccco2)cc1)N1CCCC1	C19H23NO2	beta-ketone
+CCCC(C(=O)c1ccc(-c2cccs2)cc1)N1CCCC1	C19H23NOS	beta-ketone
+CCCC(C(=O)c1ccc(-c2cccn2C)cc1)N1CCCC1	C20H26N2O	beta-ketone
+CCC(CC(=O)c1ccc(C)cc1)N1CCCC1	C16H23NO	unknown
+CCC(CC(=O)c1ccc(Cl)c(Cl)c1)N1CCCC1	C15H19Cl2NO	unknown
+CCCC(CN1CCCC1)C(=O)c1ccc(C)cc1	C17H25NO	unknown
+CCCC(CN1CCCC1)C(=O)c1ccc(Cl)c(Cl)c1	C16H21Cl2NO	unknown
+CCC(C(=O)c1ccc(Cl)c(Cl)c1)N1CCCC1	C14H17Cl2NO	beta-ketone
+C=CCC(C(=O)c1ccc(Cl)c(Cl)c1)N1CCCC1	C15H17Cl2NO	beta-ketone
+NC1=NCC(c2ccc(Cl)cc2)O1	C9H9ClN2O	unknown
+O=C1N=C(NC2CC2)OC1c1ccccc1	C12H12N2O2	unknown
+CCNC1=NC(=O)C(c2ccccc2)O1	C11H12N2O2	unknown
+NC1=NCC(c2ccc(C(F)(F)F)cc2)O1	C10H9F3N2O	unknown
+N=C1NC(=O)C(c2ccccc2)O1	C9H8N2O2	unknown
+CN(C)C1=NC(=O)C(c2ccccc2)O1	C11H12N2O2	unknown
+CC(COc1ccccc1)N(CCCl)Cc1ccccc1	C18H22ClNO	unknown
+CCCc1ccc(CC(C)NC)cc1	C13H21N	unknown
+Cc1ccc(C(C)N)cc1	C9H13N	unknown
+CNC(C)c1ccccc1	C9H13N	unknown
+COc1cccc2c1CC(N)CC2	C11H15NO	unknown
+CCCNC1CCc2cccc(OC)c2C1	C14H21NO	unknown
+CCCN(C)C1CCc2cccc(OC)c2C1	C15H23NO	unknown
+COc1cccc2c1CC(N(C)Cc1ccccc1)CC2	C19H23NO	unknown
+COc1cccc2c1CC(NCCc1ccccc1)CC2	C19H23NO	unknown
+COc1cccc2c1CC(N(C)CCc1ccccc1)CC2	C20H25NO	unknown
+COc1cccc2c1CC(NCCCc1ccccc1)CC2	C20H25NO	unknown
+COc1cccc2c1CC(NCCCCc1ccccc1)CC2	C21H27NO	unknown
+c1ccc(CCCNC2CCc3ccccc3C2)cc1	C19H23N	unknown
+Oc1cccc2c1CC(NCCCc1ccccc1)CC2	C19H23NO	unknown
+COc1cccc2c1CC(N(C)CCCc1ccccc1)CC2	C21H27NO	unknown
+c1ccc(CCCNC2CCc3cccc(OCc4ccccc4)c3C2)cc1	C26H29NO	unknown
+NCCc1cc(O)ccc1O	C8H11NO2	unknown
+Cc1cc(O)c(CCN)cc1O	C9H13NO2	unknown
+NCCc1cc(O)c([N+](=O)[O-])cc1O	C8H10N2O4	unknown
+NCCc1cc(O)c(Br)cc1O	C8H10BrNO2	unknown
+N#Cc1cc(O)c(CCN)cc1O	C9H10N2O2	unknown
+NCCc1cc(O)c(C(=O)O)cc1O	C9H11NO4	unknown
+NCCc1cc(O)c(Cl)cc1O	C8H10ClNO2	unknown
+CNC(C)C(=O)c1cc(F)cc(F)c1	C10H11F2NO	beta-ketone
+CNC(C)C(=O)c1cc(Cl)cc(Cl)c1	C10H11Cl2NO	beta-ketone
+COc1cc(CC(C)N)cc(C)c1OCc1ccccc1	C18H23NO2	unknown
+Cc1ccc(C(=O)C(CC(C)C)N2CCCC2)cc1	C17H25NO	beta-ketone
+C=CCC(C(=O)c1ccc(C)cc1)N1CCCC1	C16H21NO	beta-ketone
+CCCCNC(CCC)C(=O)c1ccc(Cl)c(Cl)c1	C15H21Cl2NO	beta-ketone
+C#CCC(C(=O)c1ccc(C)cc1)N1CCCC1	C16H19NO	beta-ketone
+CCCC(C(=O)c1ccc(Cl)c(Cl)c1)N1CCCCC1	C16H21Cl2NO	beta-ketone
+CCCC(C(O)c1ccc(C)cc1)N1CCCCC1	C17H27NO	unknown
+NC1CCC1c1ccccc1	C10H13N	unknown
+NC1CC1c1cccc(Cl)c1	C9H10ClN	unknown
+NC1CC1c1ccccc1Cl	C9H10ClN	unknown
+NC1CC1c1cc(Cl)ccc1Cl	C9H9Cl2N	unknown
+NC1CC1c1ccc(Cl)c(Cl)c1	C9H9Cl2N	unknown
+NC1CC1c1ccc(C(F)(F)F)cc1	C10H10F3N	unknown
+NC1CC1c1cccc(C(F)(F)F)c1	C10H10F3N	unknown
+Cc1ccc(C2CC2N)cc1	C10H13N	unknown
+NC1CC1c1ccc2ccccc2c1	C13H13N	unknown
+NC1CC1c1cccc2ccccc12	C13H13N	unknown
+COc1ccc(C2CC2N)cc1	C10H13NO	unknown
+CNC1CC1c1ccccc1	C10H13N	unknown
+CN(C)C1CC1c1ccccc1	C11H15N	unknown
+CCNC1CC1c1ccccc1	C11H15N	unknown
+c1ccc(CNC2CC2c2ccccc2)cc1	C16H17N	unknown
+CC(Cc1ccccc1)NC1CC1c1ccccc1	C18H21N	unknown
+CN(C)CCNC1CC1c1ccccc1	C13H20N2	unknown
+O=CNC1CC1c1ccccc1	C10H11NO	unknown
+O=C(NC1CC1c1ccccc1)C(F)(F)F	C11H10F3NO	unknown
+O=C(NC1CC1c1ccccc1)c1ccncc1	C15H14N2O	unknown
+CCOC(=O)NC1CC1c1ccccc1	C12H15NO2	unknown
+CC(C)(C)C(=O)NC1CC1c1ccccc1	C14H19NO	unknown
+c1ccc(CONC2CC2c2ccccc2)cc1	C16H17NO	unknown
+NC(=O)NC1CC1c1ccccc1	C10H12N2O	unknown
+CN(C)C(=O)NC1CC1c1ccccc1	C12H16N2O	unknown
+NNC(=O)NC1CC1c1ccccc1	C10H13N3O	unknown
+CC1(c2ccccc2)CC1N	C10H13N	unknown
+CC1(N)CC1c1ccccc1	C10H13N	unknown
+NC1CC1(c1ccccc1)c1ccccc1	C15H15N	unknown
+CC1C(N)C1c1ccccc1	C10H13N	unknown
+NC1C(c2ccccc2)C1c1ccccc1	C15H15N	unknown
+NC1(Cc2ccccc2)CC1	C10H13N	unknown
+CNC1(Cc2ccccc2)CC1	C11H15N	unknown
+CC(=O)NCCc1ccc2c(c1)OCO2	C11H13NO3	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3C(CN4)C[C@H]2N(C)C1	C20H27N3O	unknown
+CCc1ccc2[nH]cc(CCN(C)C)c2c1	C14H20N2	tryptamine
+COc1cc2[nH]cc(CCN(C)C)c2c(OC)c1OC	C15H22N2O3	tryptamine
+COc1cc2[nH]cc(CCN)c2c(OC)c1OC	C13H18N2O3	tryptamine
+COc1ccc2[nH]cc(CCN(C)CC(N)=O)c2c1	C14H19N3O2	tryptamine
+COc1ccc2[nH]cc(CCN(C)CCC#N)c2c1	C15H19N3O	tryptamine
+CN(C)CCc1c[nH]c2c(Br)cccc12	C12H15BrN2	tryptamine
+CCc1cccc2c(CCN(C)C)c[nH]c12	C14H20N2	tryptamine
+COc1cccc2[nH]c3c(c12)CCNC3	C12H14N2O	unknown
+COc1cccc2[nH]c3c(c12)CCN=C3	C12H12N2O	unknown
+COc1cccc2c3c([nH]c12)CNCC3	C12H14N2O	unknown
+COc1cccc2c3c([nH]c12)C=NCC3	C12H12N2O	unknown
+Brc1cccc2[nH]c3c(c12)CCNC3	C11H11BrN2	unknown
+Brc1ccc2[nH]c3c(c2c1)CCNC3	C11H11BrN2	unknown
+Brc1ccc2c3c([nH]c2c1)CNCC3	C11H11BrN2	unknown
+Brc1cccc2c3c([nH]c12)CNCC3	C11H11BrN2	unknown
+Brc1cccc2[nH]c3c(c12)CCN=C3	C11H9BrN2	unknown
+Brc1ccc2[nH]c3c(c2c1)CCN=C3	C11H9BrN2	unknown
+Brc1ccc2c3c([nH]c2c1)C=NCC3	C11H9BrN2	unknown
+Brc1cccc2c3c([nH]c12)C=NCC3	C11H9BrN2	unknown
+CCCCCCCCCOc1ccc2[nH]cc(CCN)c2c1	C19H30N2O	tryptamine
+Cc1c(O)c(O)cc2[nH]cc(CCN)c12	C11H14N2O2	tryptamine
+Cc1c(O)c(O)c(C)c2c(CCN)c[nH]c12	C12H16N2O2	tryptamine
+CC(N)Cc1c[nH]c2cccc(Cl)c12	C11H13ClN2	tryptamine
+CC(N)Cc1c[nH]c2cc(O)ccc12	C11H14N2O	tryptamine
+CCN(CC)CCc1c[nH]c2cccc(F)c12	C14H19FN2	tryptamine
+Fc1cccc2[nH]cc(CCN3CCOCC3)c12	C14H17FN2O	tryptamine
+Fc1cccc2[nH]cc(CCN3CCCCC3)c12	C15H19FN2	tryptamine
+CCN(CC)CCc1c[nH]c2ccc(F)cc12	C14H19FN2	tryptamine
+NCCc1c[nH]c2cc(O)ccc12	C10H12N2O	tryptamine
+N[C@@H](Cc1c[nH]c2cc(O)ccc12)C(=O)O	C11H12N2O3	tryptamine
+CNCCCc1c[nH]c2ccccc12	C12H16N2	unknown
+CCNCCCc1c[nH]c2ccccc12	C13H18N2	unknown
+CC(C)NCCCc1c[nH]c2ccccc12	C14H20N2	unknown
+CC(C)N(C)CCc1coc2ccccc12	C14H19NO	unknown
+C[C@H](N)Cn1ncc2ccc3c(c21)CCCO3	C13H17N3O	unknown
+C[C@H](N)Cn1ncc2ccc(O)cc21	C10H13N3O	unknown
+CN1CCCC2c3cccc4[nH]cc(c34)C[C@H]21	C15H18N2	unknown
+CCc1ccc2[nH]cc(CCN)c2c1	C12H16N2	tryptamine
+CC(=O)c1ccc2[nH]cc(CCN)c2c1	C12H14N2O	tryptamine
+CCC(=O)Oc1ccc2[nH]cc(CCN)c2c1	C13H16N2O2	tryptamine
+CC(C)C(=O)Oc1ccc2[nH]cc(CCN)c2c1	C14H18N2O2	tryptamine
+CC(C)(C)C(=O)Oc1ccc2[nH]cc(CCN)c2c1	C15H20N2O2	tryptamine
+CC(N)Cc1csc2c1OCO2	C8H11NO2S	unknown
+Cc1ccc(N(C)C)c(CC(C)N)c1	C12H20N2	unknown
+COc1ccc(NC(N)=S)c(CCN)c1	C10H15N3OS	unknown
+COc1ccc(NC(N)=O)c(CCN)c1	C10H15N3O2	unknown
+Cc1cccc(C2CN=C(N)O2)c1	C10H12N2O	unknown
+C[N+](C)([O-])CCc1c[nH]c2ccc(O)cc12	C12H16N2O2	tryptamine
+COc1cc(Br)c2[nH]cc(CC(C)N)c2c1	C12H15BrN2O	tryptamine
+COc1cc(Br)c2c(c1)C(CC(C)N)CO2	C12H16BrNO2	unknown
+COc1cc(Br)c2c(c1)C(CC(C)N)CS2	C12H16BrNOS	unknown
+CCC(N)Cc1c[nH]c2ccc(OC)c(Br)c12	C13H17BrN2O	tryptamine
+COc1cc2c(CC(C)N)c[nH]c2cc1Br	C12H15BrN2O	tryptamine
+CCC(N)Cc1c[nH]c2cc(Br)c(OC)cc12	C13H17BrN2O	tryptamine
+CCC(N)Cc1c[nH]c2c(Br)cc(OC)cc12	C13H17BrN2O	tryptamine
+COc1cc(CC(C)N)c(OC)cc1CBr	C12H18BrNO2	unknown
+COc1cc(CC(C)N)c(OC)cc1CCl	C12H18ClNO2	unknown
+COc1cc(CC(C)N)c(OC)cc1CCCl	C13H20ClNO2	unknown
+COc1cc(CC(C)N)c(OC)cc1CCC(F)(F)F	C14H20F3NO2	unknown
+COc1cc(CC(C)N)c(OC)cc1CS	C12H19NO2S	unknown
+COc1cc(CC(C)N)c(OC)cc1CSC	C13H21NO2S	unknown
+COCc1cc(OC)c(CC(C)N)cc1OC	C13H21NO3	unknown
+COc1cc(NC=O)c(OC)cc1CC(C)N	C12H18N2O3	unknown
+CCC(=O)Nc1cc(OC)c(CC(C)N)cc1OC	C14H22N2O3	unknown
+COc1cc(NC(=O)C(F)(F)F)c(OC)cc1CC(C)N	C13H17F3N2O3	unknown
+COc1cc(Br)c(C#N)cc1CC(C)N	C11H13BrN2O	unknown
+COc1cc(Br)c(NC=O)cc1CC(C)N	C11H15BrN2O2	unknown
+CCCc1c(OC)cc(CC(C)N)cc1OC	C14H23NO2	unknown
+CCc1cc(OC)c(CC(N)Cl)cc1OC	C12H18ClNO2	unknown
+COc1cc(CCN2CCCN(C)CC2)cc(OC)c1OC	C17H28N2O3	unknown
+COc1cc(CCN2CCN(C)CC2)cc(OC)c1OC	C16H26N2O3	unknown
+COc1cc(CCN2CCCN(CCc3cc(OC)c(OC)c(OC)c3)CC2)cc(OC)c1OC	C27H40N2O6	unknown
+COc1cc(CCN2CCN(CCc3cc(OC)c(OC)c(OC)c3)CC2)cc(OC)c1OC	C26H38N2O6	unknown
+CC(Cc1ccccc1)N(C=O)C(C)Cc1ccccc1	C19H23NO	unknown
+COc1ccccc1CC(C)N(C=O)C(C)Cc1ccccc1OC	C21H27NO3	unknown
+COc1cccc(CC(C)N(C=O)C(C)Cc2cccc(OC)c2)c1	C21H27NO3	unknown
+COc1ccc(CC(C)N(C=O)C(C)Cc2ccc(OC)cc2)cc1	C21H27NO3	unknown
+CC(Cc1ccc2c(c1)OCO2)N(C=O)C(C)Cc1ccc2c(c1)OCO2	C21H23NO5	unknown
+CSc1ccc(CC(C)N(C=O)C(C)Cc2ccc(SC)cc2)cc1	C21H27NOS2	unknown
+Cc1ccc(CC(C)N(C=O)C(C)Cc2ccc(C)cc2)cc1	C21H27NO	unknown
+CC(Cc1ccc(F)cc1)N(C=O)C(C)Cc1ccc(F)cc1	C19H21F2NO	unknown
+COc1ccc(OC)c(CC(C)N(C=O)C(C)Cc2cc(OC)ccc2OC)c1	C23H31NO5	unknown
+COc1cc(OC)c(OC)cc1CC(C)N(C=O)C(C)Cc1cc(OC)c(OC)cc1OC	C25H35NO7	unknown
+COc1cc(CC(C)N(C=O)C(C)Cc2cc(OC)c(OC)c(OC)c2)cc(OC)c1OC	C25H35NO7	unknown
+CCCN(CCc1ccccc1)CCc1cccc(O)c1	C19H25NO	unknown
+CCCCCN(CCc1ccccc1)CCc1cccc(O)c1	C21H29NO	unknown
+Oc1cccc(CCN(CCc2ccccc2)CC2CC2)c1	C20H25NO	unknown
+Oc1cccc(CCN(CCc2ccccc2)CC2CCC2)c1	C21H27NO	unknown
+CCCCN(CCc1ccccc1)CCc1cccc(O)c1	C20H27NO	unknown
+CCCCCCN(CCc1ccccc1)CCc1cccc(O)c1	C22H31NO	unknown
+COc1cc(Br)c2occ(CC(C)N)c2c1	C12H14BrNO2	unknown
+Cc1[nH]c2ccc(O)cc2c1CCN	C11H14N2O	tryptamine
+COc1ccc2[nH]c(C)c(CCN)c2c1	C12H16N2O	tryptamine
+COc1ccc2c(c1)c(CCN(C)C)cn2C	C14H20N2O	tryptamine
+CCn1cc(CCN(C)C)c2cc(OC)ccc21	C15H22N2O	tryptamine
+CCCn1cc(CCN(C)C)c2cc(OC)ccc21	C16H24N2O	tryptamine
+COc1ccc2c(c1)c(CCN(C)C)c1n2CCCC1	C17H24N2O	tryptamine
+COc1ccc2[nH]c3c(c2c1)C(CN(C)C)CCC3	C16H22N2O	unknown
+COc1cc(CC(C)(N)C(=O)O)c(OC)cc1C	C13H19NO4	unknown
+CC(N)C(O)c1cccc(O)c1	C9H13NO2	unknown
+Oc1cccc(N2CCN(CCCc3ccccc3)CC2)c1	C19H24N2O	unknown
+CC1CN(CCCc2ccccc2)CCN1c1cccc(O)c1	C20H26N2O	unknown
+CC1CN(CCCc2ccccc2)CC(C)N1c1cccc(O)c1	C21H28N2O	unknown
+CC1CN(c2cccc(O)c2)C(C)CN1CCCc1ccccc1	C21H28N2O	unknown
+CC1CN(C)CCN1c1cccc(O)c1	C12H18N2O	unknown
+CC1CN(C)CC[C@@]1(C)c1cccc(O)c1	C14H21NO	unknown
+CC1CN(CCCc2ccccc2)CC[C@@]1(C)c1cccc(O)c1	C22H29NO	unknown
+NCCc1c2c(cc3c1OCCC3)OCC2	C13H17NO2	unknown
+NCCc1c2c(cc3c1OCC3)OCCC2	C13H17NO2	unknown
+CNC1C(=O)c2ccccc2C1=O	C10H9NO2	unknown
+NC1Cc2cccc(I)c2C1	C9H10IN	unknown
+CCCNC(CC)Cc1ccc(SC)cc1	C14H23NS	unknown
+COc1cc(CC(C)N)c(OC)cc1CC#N	C13H18N2O2	unknown
+Oc1cc2c(cc1O)[C@H]1c3ccccc3CN[C@@H]1CC2	C17H17NO2	unknown
+Oc1cc2c(cc1O)[C@H]1c3ccccc3CN[C@@H]1CO2	C16H15NO3	unknown
+CC(N)Cc1c2c(cc3c1OCC3)OCCC2	C14H19NO2	unknown
+CC(N)Cc1c2c(cc3c1OCCC3)OCC2	C14H19NO2	unknown
+NCCc1c2c(c(Br)c3c1OCC3)OCCC2	C13H16BrNO2	unknown
+NCCc1c2c(c(Br)c3c1OCCC3)OCC2	C13H16BrNO2	unknown
+CC(Cc1ccccc1)N(C)C(C)Cc1ccccc1	C19H25N	unknown
+COc1cc(CC(C)N)ccc1OCc1ccccc1	C17H21NO2	unknown
+CCCOc1cc(Cl)c(CC(C)N)cc1OC	C13H20ClNO2	unknown
+COc1cc(CC(C)N)ccc1OC(C)C	C13H21NO2	unknown
+CCCOc1ccc(CC(C)N)cc1OC	C13H21NO2	unknown
+NCCc1ccccc1F	C8H10FN	unknown
+NCCc1cccc(F)c1	C8H10FN	unknown
+NCCc1cccc(Br)c1	C8H10BrN	unknown
+NCCc1ccccc1I	C8H10IN	unknown
+NCCc1ccc(C(F)(F)F)cc1	C9H10F3N	unknown
+NCCc1ccc([N+](=O)[O-])cc1	C8H10N2O2	unknown
+NCCc1c(Cl)cccc1Cl	C8H9Cl2N	unknown
+NCCc1c(F)cccc1Cl	C8H9ClFN	unknown
+COc1cc(F)c(CCN)c(F)c1	C9H11F2NO	unknown
+NCCc1c(F)cc(O)cc1F	C8H9F2NO	unknown
+NCCc1cccc(Cl)c1Cl	C8H9Cl2N	unknown
+CC(C)(CN)c1ccccc1	C10H15N	unknown
+NCC1(c2ccccc2)CC1	C10H13N	unknown
+CC(C)C(CN)c1ccccc1	C11H17N	unknown
+NCC(c1ccccc1)c1ccccc1	C14H15N	unknown
+CNCCc1ccccc1F	C9H12FN	unknown
+CN(C)CCc1ccccc1F	C10H14FN	unknown
+CNCCc1cccc(F)c1	C9H12FN	unknown
+CN(C)CCc1cccc(F)c1	C10H14FN	unknown
+CNCCc1ccc(F)cc1	C9H12FN	unknown
+CN(C)CCc1ccc(F)cc1	C10H14FN	unknown
+CNCCc1ccccc1Cl	C9H12ClN	unknown
+CN(C)CCc1ccccc1Cl	C10H14ClN	unknown
+CNCCc1cccc(Cl)c1	C9H12ClN	unknown
+CN(C)CCc1cccc(Cl)c1	C10H14ClN	unknown
+CNCCc1ccc(Cl)cc1	C9H12ClN	unknown
+CN(C)CCc1ccc(Cl)cc1	C10H14ClN	unknown
+CNCCc1ccccc1Br	C9H12BrN	unknown
+CN(C)CCc1ccccc1Br	C10H14BrN	unknown
+CNCCc1cccc(Br)c1	C9H12BrN	unknown
+CN(C)CCc1cccc(Br)c1	C10H14BrN	unknown
+CNCCc1ccc(Br)cc1	C9H12BrN	unknown
+CN(C)CCc1ccc(Br)cc1	C10H14BrN	unknown
+CSc1ccc(CC(Cc2ccc(SC)cc2)NC=O)cc1	C18H21NOS2	unknown
+CC(N)Cc1ccc(SCCN(C)C)cc1	C13H22N2S	unknown
+CC(N)Cc1ccc(Sc2ccccc2)cc1	C15H17NS	unknown
+CCSc1ccc(CC(C)NC)cc1	C12H19NS	unknown
+CCNC(C)Cc1ccc(SCC)cc1	C13H21NS	unknown
+CCSc1ccc(CC(C)NO)cc1	C11H17NOS	unknown
+CCSc1ccc(CC(C)N(C)O)cc1	C12H19NOS	unknown
+CCSc1ccc(CC(N)CC)cc1	C12H19NS	unknown
+CCSc1ccc(CC(CC)NC)cc1	C13H21NS	unknown
+CCNC(CC)Cc1ccc(SCC)cc1	C14H23NS	unknown
+CCSc1ccc(CC(CC)NO)cc1	C12H19NOS	unknown
+CCSc1ccc(CC(CC)N(C)O)cc1	C13H21NOS	unknown
+CC(N)Cc1ccc(SC(C)(C)C)cc1	C13H21NS	unknown
+CON(C)C(C)Cc1ccc(SC)cc1	C12H19NOS	unknown
+CSc1ccc(CC(C)N(C)O)cc1	C11H17NOS	unknown
+CONC(C)Cc1ccc(SC)cc1	C11H17NOS	unknown
+CSc1ccc(CC(C)NO)cc1	C10H15NOS	unknown
+COCCNC(C)Cc1ccc(SC)cc1	C13H21NOS	unknown
+CSc1ccc(CC(C)NCCO)cc1	C12H19NOS	unknown
+C#CNC(C)Cc1ccc(SC)cc1	C12H15NS	unknown
+CSc1ccc(CC(C)NC2CC2)cc1	C13H19NS	unknown
+CSc1ccc(CC(C)NC(C)C)cc1	C13H21NS	unknown
+COc1ccc(CC(Cc2ccc(OC)cc2)NC(C)=O)cc1	C19H23NO3	unknown
+COc1ccc(CC(N)Cc2ccc(OC)cc2)cc1	C17H21NO2	unknown
+CC(=O)NC(Cc1ccc2c(c1)OCO2)Cc1ccc2c(c1)OCO2	C19H19NO5	unknown
+O=CNC(Cc1ccc2c(c1)OCO2)Cc1ccc2c(c1)OCO2	C18H17NO5	unknown
+CN(CCc1c[nH]c2cccc(O)c12)C1CC1	C14H18N2O	tryptamine
+CSc1ccc(CC(Cc2ccc(SC)cc2)NC(C)=O)cc1	C19H23NOS2	unknown
+CCNC(Cc1ccc(SC)cc1)Cc1ccc(SC)cc1	C19H25NS2	unknown
+CC(N)Cc1ccc(SCc2ccccc2)cc1	C16H19NS	unknown
+CSc1ccc(CC(N)Cc2ccc(SC)cc2)cc1	C17H21NS2	unknown
+CSc1ccc(CC(C)NC(C)Cc2ccc(SC)cc2)cc1	C20H27NS2	unknown
+CCC(Cc1ccc(SC)cc1)NC	C12H19NS	unknown
+CCNC(CC)Cc1ccc(SC)cc1	C13H21NS	unknown
+Cc1ccc(O)cc1CC(C)N	C10H15NO	unknown
+CCC(Cc1ccc(SC)cc1)NC1CC1	C14H21NS	unknown
+C#CNC(CC)Cc1ccc(SC)cc1	C13H17NS	unknown
+CCC(Cc1ccc(SC)cc1)NCCOC	C14H23NOS	unknown
+CCC(Cc1ccc(SC)cc1)NO	C11H17NOS	unknown
+CCC(Cc1ccc(SC)cc1)N(C)OC	C13H21NOS	unknown
+CCCCCSc1ccc(CC(N)CC)cc1	C15H25NS	unknown
+CCNC(C)Cc1ccccc1F	C11H16FN	unknown
+CCCNC(C)Cc1ccccc1F	C12H18FN	unknown
+CC(C)NC(C)Cc1ccccc1F	C12H18FN	unknown
+CC(Cc1ccccc1F)N(C)C	C11H16FN	unknown
+CCN(CC)C(C)Cc1ccccc1F	C13H20FN	unknown
+CCCN(CCC)C(C)Cc1ccccc1F	C15H24FN	unknown
+CCCNC(C)Cc1cccc(F)c1	C12H18FN	unknown
+CC(C)NC(C)Cc1cccc(F)c1	C12H18FN	unknown
+CC(Cc1cccc(F)c1)N(C)C	C11H16FN	unknown
+CCN(CC)C(C)Cc1cccc(F)c1	C13H20FN	unknown
+CCCN(CCC)C(C)Cc1cccc(F)c1	C15H24FN	unknown
+CCCNC(C)Cc1ccc(F)cc1	C12H18FN	unknown
+CC(C)NC(C)Cc1ccc(F)cc1	C12H18FN	unknown
+CC(Cc1ccc(F)cc1)N(C)C	C11H16FN	unknown
+CCN(CC)C(C)Cc1ccc(F)cc1	C13H20FN	unknown
+CCCN(CCC)C(C)Cc1ccc(F)cc1	C15H24FN	unknown
+CCC(Cc1ccc(F)cc1)NC	C11H16FN	unknown
+CCNC(CC)Cc1ccc(F)cc1	C12H18FN	unknown
+CCC(Cc1ccc(F)cc1)N(C)C	C12H18FN	unknown
+CCC(Cc1ccc(F)cc1)N(CC)CC	C14H22FN	unknown
+COc1ccccc1C(=O)CN(C)C	C11H15NO2	beta-ketone
+COc1cccc(C(=O)CN(C)C)c1	C11H15NO2	beta-ketone
+COc1ccc(C(=O)CN(C)C)cc1	C11H15NO2	beta-ketone
+COc1cc(CCN(C)C)ccc1C	C12H19NO	unknown
+COc1ccc(CCN(C)C)cc1C	C12H19NO	unknown
+CNC(C(C)=O)c1ccc(C)cc1	C11H15NO	unknown
+CCNC(C(C)=O)c1ccccc1	C11H15NO	unknown
+CCCC(=O)C(NC)c1ccccc1	C12H17NO	unknown
+CCCC(=O)C(NC)c1ccc2c(c1)OCO2	C13H17NO3	unknown
+CC(Cc1ccccc1)N(C)Cc1ccccc1	C17H21N	unknown
+CC(Cc1ccc(O)cc1)NCc1ccccc1	C16H19NO	unknown
+C#CCNC(C)Cc1ccccc1	C12H15N	unknown
+CCC(N)C(=O)c1ccc2c(c1)OCO2	C11H13NO3	beta-ketone
+CC(Cc1ccccc1)[N+](C)(C)[O-]	C11H17NO	unknown
+CNCCc1ccccc1C	C10H15N	unknown
+CNCCc1cccc(C)c1	C10H15N	unknown
+CC(C(=O)c1ccccc1F)N(C)C	C11H14FNO	beta-ketone
+CCNC(C)C(=O)c1ccccc1F	C11H14FNO	beta-ketone
+CCN(CC)C(C)C(=O)c1ccccc1F	C13H18FNO	beta-ketone
+CCN(C)C(C)C(=O)c1ccccc1F	C12H16FNO	beta-ketone
+CCCNC(C)C(=O)c1ccccc1F	C12H16FNO	beta-ketone
+CCCN(CCC)C(C)C(=O)c1ccccc1F	C15H22FNO	beta-ketone
+CC(C)NC(C)C(=O)c1ccccc1F	C12H16FNO	beta-ketone
+CCCN(C)C(C)C(=O)c1ccccc1F	C13H18FNO	beta-ketone
+CCCCN(C)C(C)C(=O)c1ccccc1F	C14H20FNO	beta-ketone
+CC(C(=O)c1cccc(F)c1)N(C)C	C11H14FNO	beta-ketone
+CCNC(C)C(=O)c1cccc(F)c1	C11H14FNO	beta-ketone
+CCN(CC)C(C)C(=O)c1cccc(F)c1	C13H18FNO	beta-ketone
+CCN(C)C(C)C(=O)c1cccc(F)c1	C12H16FNO	beta-ketone
+CCCNC(C)C(=O)c1cccc(F)c1	C12H16FNO	beta-ketone
+CC(C)NC(C)C(=O)c1cccc(F)c1	C12H16FNO	beta-ketone
+CCCN(C)C(C)C(=O)c1cccc(F)c1	C13H18FNO	beta-ketone
+CCCCN(C)C(C)C(=O)c1cccc(F)c1	C14H20FNO	beta-ketone
+CC(C(=O)c1ccc(F)cc1)N(C)C	C11H14FNO	beta-ketone
+CCN(CC)C(C)C(=O)c1ccc(F)cc1	C13H18FNO	beta-ketone
+CCN(C)C(C)C(=O)c1ccc(F)cc1	C12H16FNO	beta-ketone
+CCCN(C)C(C)C(=O)c1ccc(F)cc1	C13H18FNO	beta-ketone
+CCCCN(C)C(C)C(=O)c1ccc(F)cc1	C14H20FNO	beta-ketone
+CC(C)C(C(=O)c1ccc2c(c1)OCO2)N1CCCC1	C16H21NO3	beta-ketone
+CC(C(=O)c1ccc2c(c1)OCO2)N1CCCCC1	C15H19NO3	beta-ketone
+CCC(C(=O)c1ccc2c(c1)OCO2)N1CCCCC1	C16H21NO3	beta-ketone
+CCCC(C(=O)c1ccc2c(c1)OCO2)N1CCCCC1	C17H23NO3	beta-ketone
+CC(C(=O)c1ccc2c(c1)OCO2)N1CCCCCC1	C16H21NO3	beta-ketone
+CCC(C(=O)c1ccc2c(c1)OCO2)N1CCCCCC1	C17H23NO3	beta-ketone
+CCCC(C(=O)c1ccc2c(c1)OCO2)N1CCCCCC1	C18H25NO3	beta-ketone
+CC(Cc1ccc2c(c1)OCO2)C(N)=O	C11H13NO3	unknown
+CSc1ccc(CC(C)NC=O)cc1	C11H15NOS	unknown
+CCC(Cc1ccc(SC)cc1)NC=O	C12H17NOS	unknown
+c1cc2c3c(c[nH]c3c1)C[C@H]1NCCC[C@H]21	C14H16N2	unknown
+Cc1c2ccoc2c(CC(C)N)c2occc12	C14H15NO2	unknown
+CCCNC(C)C(=O)c1ccc(F)cc1	C12H16FNO	beta-ketone
+CC(C)NC(C)C(=O)c1ccc(F)cc1	C12H16FNO	beta-ketone
+CCCCCCN(CCCCCC)CCc1c[nH]c2ccccc12	C22H36N2	tryptamine
+CNCC1CCc2ccccc2C1=O	C12H15NO	unknown
+CNC(C)Cc1ccc2ccoc2c1	C12H15NO	unknown
+CNC(C)Cc1ccc2occc2c1	C12H15NO	unknown
+CCNC(C)Cc1ccc2ccoc2c1	C13H17NO	unknown
+CCNC(C)Cc1ccc2occc2c1	C13H17NO	unknown
+CNC(C)Cc1ccc2c(c1)OCC2	C12H17NO	unknown
+CNC(C)Cc1ccc2c(c1)CCO2	C12H17NO	unknown
+CCNC(C)Cc1ccc2c(c1)OCC2	C13H19NO	unknown
+CCNC(C)Cc1ccc2c(c1)CCO2	C13H19NO	unknown
+COc1ccc(C(=O)N2CCN(C)CC2)cc1	C13H18N2O2	unknown
+COC(=O)C(c1ccc(Cl)c(Cl)c1)C1CCCCN1	C14H17Cl2NO2	unknown
+COc1cc(C)c(CCNCc2ccccc2OC)cc1C	C19H25NO2	unknown
+COc1ccc(CC(C)NCc2ccccc2OC)c(OC)c1	C19H25NO3	unknown
+COc1cc(CC(C)NCc2ccccc2OC)c(OC)cc1Cl	C19H24ClNO3	unknown
+CCN(C)C(C)C(=O)c1ccccc1	C12H17NO	beta-ketone
+COc1ccc(S(=O)(=O)n2cc(CCN(C)C)c3c(OC)cccc32)cc1	C20H24N2O4S	tryptamine
+COc1cccc2c1c(CCN(C)C)cn2S(=O)(=O)c1ccc(C(F)(F)F)cc1	C20H21F3N2O3S	tryptamine
+COc1cccc2c1c(CCN(C)C)cn2S(=O)(=O)c1ccc(Cl)cc1	C19H21ClN2O3S	tryptamine
+COc1cccc2c1c(CCN(C)C)cn2Sc1ccccc1	C19H22N2OS	tryptamine
+COc1cccc2[nH]c3c(c12)CCN(C)C3	C13H16N2O	unknown
+COc1cccc2[nH]c3c(c12)CCN(C)C3C	C14H18N2O	unknown
+Oc1cccc2[nH]c3c(c12)CCNC3	C11H12N2O	unknown
+CN1CCc2c([nH]c3cccc(O)c23)C1	C12H14N2O	unknown
+CC1NCCc2c1[nH]c1cccc(O)c21	C12H14N2O	unknown
+CC1c2[nH]c3cccc(O)c3c2CCN1C	C13H16N2O	unknown
+c1[nH]c2cc3c(cc2c1CCNC1CC1)OCO3	C14H16N2O2	tryptamine
+CN(CCc1c[nH]c2cc3c(cc12)OCO3)C1CC1	C15H18N2O2	tryptamine
+CN(CCc1c[nH]c2cc3c(cc12)OCO3)C1CCC1	C16H20N2O2	tryptamine
+CN(CCc1c[nH]c2cc3c(cc12)OCO3)CC1CC1	C16H20N2O2	tryptamine
+CN(CCc1c[nH]c2cc3c(cc12)OCO3)C1CCCC1	C17H22N2O2	tryptamine
+c1ccc(CN(CCc2c[nH]c3cc4c(cc23)OCO4)C2CC2)cc1	C21H22N2O2	tryptamine
+c1[nH]c2cc3c(cc2c1CCN1CCCC1)OCO3	C15H18N2O2	tryptamine
+c1[nH]c2cc3c(cc2c1CCN1CCCCC1)OCO3	C16H20N2O2	tryptamine
+c1[nH]c2cc3c(cc2c1CCN1CCOCC1)OCO3	C15H18N2O3	tryptamine
+c1ccc(N2CCN(CCc3c[nH]c4cc5c(cc34)OCO5)CC2)cc1	C21H23N3O2	tryptamine
+c1ccc(CN2CCN(CCc3c[nH]c4cc5c(cc34)OCO5)CC2)cc1	C22H25N3O2	tryptamine
+Fc1ccc(N2CCN(CCc3c[nH]c4cc5c(cc34)OCO5)CC2)cc1	C21H22FN3O2	tryptamine
+c1ccc2c(c1)CCC1OCCNC21	C12H15NO	unknown
+CN1C[C@H](CN)C[C@@H]2c3cccc4[nH]cc(c34)C[C@H]21	C16H21N3	unknown
+CC(=O)NC[C@@H]1C[C@@H]2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C18H23N3O	unknown
+CC(=O)NC[C@@H]1C[C@@H]2c3cccc4c3c(cn4C)C[C@H]2N(C)C1	C19H25N3O	unknown
+CC(=O)NC[C@H]1CN(C)[C@@H]2Cc3c[nH]c4cccc(c34)[C@@]2(O)C1	C18H23N3O2	unknown
+CC(=O)NC(C)[C@@H]1C[C@@H]2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C19H25N3O	unknown
+CC(=O)N(C)C[C@@H]1C[C@@H]2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C19H25N3O	unknown
+CCN(C[C@@H]1C[C@@H]2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1)C(C)=O	C20H27N3O	unknown
+CC(=O)N(C[C@@H]1C[C@@H]2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1)C(C)C	C21H29N3O	unknown
+CCC(=O)NC[C@@H]1C[C@@H]2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C19H25N3O	unknown
+CCC(=O)NC[C@@H]1C[C@@H]2c3cccc4c3c(cn4C)C[C@H]2N(C)C1	C20H27N3O	unknown
+CCC(=O)N(C)C[C@@H]1C[C@@H]2c3cccc4c3c(cn4C)C[C@H]2N(C)C1	C21H29N3O	unknown
+CC(C)C(=O)NC[C@@H]1C[C@@H]2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C20H27N3O	unknown
+CC(C)C(=O)NC[C@@H]1C[C@@H]2c3cccc4c3c(cn4C)C[C@H]2N(C)C1	C21H29N3O	unknown
+CN1C[C@H](CNC(=O)C(C)(C)C)C[C@@H]2c3cccc4[nH]cc(c34)C[C@H]21	C21H29N3O	unknown
+CCC(CC)C(=O)NC[C@@H]1C[C@@H]2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C22H31N3O	unknown
+CCCCC(=O)NC[C@@H]1C[C@@H]2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C21H29N3O	tryptamine
+CN1C[C@H](CNC(=O)CCc2ccccc2)C[C@@H]2c3cccc4[nH]cc(c34)C[C@H]21	C25H29N3O	unknown
+CN1C[C@H](CNC(=O)c2ccccc2)C[C@@H]2c3cccc4[nH]cc(c34)C[C@H]21	C23H25N3O	unknown
+CC(NC(=O)c1ccccc1)[C@@H]1C[C@@H]2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C24H27N3O	unknown
+CN(C[C@@H]1C[C@@H]2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1)C(=O)c1ccccc1	C24H27N3O	unknown
+CN(C[C@H]1CN(C)[C@@H]2Cc3c[nH]c4cccc(c34)[C@@]2(O)C1)C(=O)c1ccccc1	C24H27N3O2	unknown
+CN1C[C@H](CNC(=O)c2cccnc2)C[C@@H]2c3cccc4[nH]cc(c34)C[C@H]21	C22H24N4O	unknown
+COc1ccc(CCN)c(OC)c1C	C11H17NO2	unknown
+COc1cccc(CNCCc2cc(OC)ccc2OC)c1	C18H23NO3	unknown
+COc1ccc(CNCCc2cc(OC)ccc2OC)cc1	C18H23NO3	unknown
+COc1cccc(CNCCc2cc(OC)c(Cl)cc2OC)c1	C18H22ClNO3	unknown
+COc1ccc(CNCCc2cc(OC)c(Cl)cc2OC)cc1	C18H22ClNO3	unknown
+COc1cccc(CNCCc2cc(OC)c(C)cc2OC)c1	C19H25NO3	unknown
+COc1ccc(CNCCc2cc(OC)c(C)cc2OC)cc1	C19H25NO3	unknown
+COc1cccc(CNCCc2cc(OC)c(I)cc2OC)c1	C18H22INO3	unknown
+COc1ccc(CNCCc2cc(OC)c(I)cc2OC)cc1	C18H22INO3	unknown
+CCc1cc(OC)c(CCNCc2cccc(OC)c2)cc1OC	C20H27NO3	unknown
+CCc1cc(OC)c(CCNCc2ccc(OC)cc2)cc1OC	C20H27NO3	unknown
+COc1cccc(CNCCc2cc(OC)c([N+](=O)[O-])cc2OC)c1	C18H22N2O5	unknown
+COc1ccc(CNCCc2cc(OC)c([N+](=O)[O-])cc2OC)cc1	C18H22N2O5	unknown
+CCCc1cc(OC)c(CCNCc2cccc(OC)c2)cc1OC	C21H29NO3	unknown
+CCCc1cc(OC)c(CCNCc2ccc(OC)cc2)cc1OC	C21H29NO3	unknown
+CCSc1cc(OC)c(CCNCc2cccc(OC)c2)cc1OC	C20H27NO3S	unknown
+CCSc1cc(OC)c(CCNCc2ccc(OC)cc2)cc1OC	C20H27NO3S	unknown
+COc1cccc(CNCCc2cc(OC)c(SC(C)C)cc2OC)c1	C21H29NO3S	unknown
+COc1ccc(CNCCc2cc(OC)c(SC(C)C)cc2OC)cc1	C21H29NO3S	unknown
+CCCSc1cc(OC)c(CCNCc2cccc(OC)c2)cc1OC	C21H29NO3S	unknown
+CCCSc1cc(OC)c(CCNCc2ccc(OC)cc2)cc1OC	C21H29NO3S	unknown
+COc1cccc(CNCCc2cc(OC)c(Br)cc2OC)c1	C18H22BrNO3	unknown
+CNC(C)C(=O)c1ccc(I)cc1	C10H12INO	beta-ketone
+CN1CCC=C2c3cccc4[nH]cc(c34)C[C@H]21	C15H16N2	unknown
+CC(Cc1ccccc1)NCCO	C11H17NO	unknown
+COc1cc(OC)c(C(=O)CCCN2CCCC2)c(OC)c1	C17H25NO4	unknown
+COc1cc(CC(C)N)c(OC)cc1CO	C12H19NO3	unknown
+CC(N)C(O)c1ccccc1	C9H13NO	unknown
+CNC(C)C(O)c1ccccc1	C10H15NO	unknown
+COc1cc(C(O)C(C)N)c(OC)cc1C	C12H19NO3	unknown
+CNC(C)C(=O)c1cccc(C)c1C	C12H17NO	beta-ketone
+O=S(=O)(N=C1CCCCN1CCc1ccccc1)c1ccc(Cl)cc1	C19H21ClN2O2S	unknown
+COc1cc(C(=O)CN)c(OC)cc1Br	C10H12BrNO3	beta-ketone
+Cc1ccc(C2OCCN(C)C2C)cc1	C13H19NO	unknown
+CCCC(C(=O)c1cccs1)N1CCCC1	C13H19NOS	unknown
+CC(Cc1ccccc1)NC(C)Cc1ccccc1	C18H23N	unknown
+CC(NCc1ccccc1)c1ccccc1	C15H17N	unknown
+CNC(C)C(=O)c1ccc(C)cc1C	C12H17NO	beta-ketone
+CNC(C)C(=O)c1cc(C)ccc1C	C12H17NO	beta-ketone
+CNC(C)C(=O)c1c(C)cccc1C	C12H17NO	beta-ketone
+CNC(C)C(=O)c1cc(C)cc(C)c1	C12H17NO	beta-ketone
+CC(N)Cc1cccc2ccoc12	C11H13NO	unknown
+CCC(N)c1ccccc1	C9H13N	unknown
+CC(N)CCc1ccccc1	C10H15N	unknown
+CC(N)Cc1cccc2c1OCC2	C11H15NO	unknown
+c1ccc(C2CN3CCSC3=N2)cc1	C11H12N2S	unknown
+COc1cccc(CCNCc2cc(OC)c(OC)c(OC)c2)c1OC	C20H27NO5	unknown
+CCNC(CC)Cc1ccccc1	C12H19N	unknown
+COc1cc(CCN(Cc2ccccc2OC)Cc2ccccc2OC)c(OC)cc1Br	C26H30BrNO4	unknown
+COc1cc(C2CNCCO2)c(OC)cc1Br	C12H16BrNO3	unknown
+COc1ccc(CC(C)NC(C)=O)cc1	C12H17NO2	unknown
+CC(=O)NC(C)Cc1ccc(OC(C)=O)cc1	C13H17NO3	unknown
+CC(=O)NC(C)Cc1ccc(O)cc1	C11H15NO2	unknown
+COc1cccc(CC(C)NC(C)=O)c1	C12H17NO2	unknown
+CCC1N=C(N)OC1c1ccc2c(c1)OCO2	C12H14N2O3	unknown
+COc1cccc(CN2CCNCC2)c1OC	C13H20N2O2	unknown
+COc1ccc(CN2CCNCC2)c(OC)c1	C13H20N2O2	unknown
+COc1ccc(OC)c(CN2CCNCC2)c1	C13H20N2O2	unknown
+COc1cccc(OC)c1CN1CCNCC1	C13H20N2O2	unknown
+COc1ccc(CN2CCNCC2)cc1OC	C13H20N2O2	unknown
+COc1cc(CN2CCNCC2)cc(OC)c1	C13H20N2O2	unknown
+CCNCc1ccccc1	C9H13N	unknown
+CC(C)NCc1ccccc1	C10H15N	unknown
+CC(Cc1ccccc1)NCc1ccccc1Cl	C16H18ClN	unknown
+CCN(C)[C@@H](C)[C@H](O)c1ccccc1	C12H19NO	unknown
+CN[C@@H](C)[C@H](O)c1ccc(F)cc1	C10H14FNO	unknown
+COc1cc(CCNCc2cc(OC)c(OC)c(OC)c2)c(OC)cc1Cl	C20H26ClNO5	unknown
+CN(C)CCC(=O)c1ccccc1N	C11H16N2O	unknown
+O=[N+]([O-])c1ccc(CC(NCc2ccccc2)C(F)(F)F)cc1	C16H15F3N2O2	unknown
+O=[N+]([O-])c1ccc(CC(NCCc2ccccc2)C(F)(F)F)cc1	C17H17F3N2O2	unknown
+COc1ccc(NC(Cc2ccc([N+](=O)[O-])cc2)C(F)(F)F)cc1	C16H15F3N2O3	unknown
+O=[N+]([O-])c1ccccc1CC(NCc1ccccc1)C(F)(F)F	C16H15F3N2O2	unknown
+O=[N+]([O-])c1ccccc1CC(NCCc1ccccc1)C(F)(F)F	C17H17F3N2O2	unknown
+COc1ccc(NC(Cc2ccccc2[N+](=O)[O-])C(F)(F)F)cc1	C16H15F3N2O3	unknown
+CCCCNC(Cc1ccccc1[N+](=O)[O-])C(F)(F)F	C13H17F3N2O2	unknown
+COc1ccc(CNC(Cc2ccccc2[N+](=O)[O-])C(F)(F)F)cc1	C17H17F3N2O3	unknown
+O=[N+]([O-])c1ccccc1CC(NCc1ccc(F)cc1)C(F)(F)F	C16H14F4N2O2	unknown
+CC1NC(C)(C)COC1c1cccc(Cl)c1	C13H18ClNO	unknown
+CC1NC(C)(C)COC1c1cccc(F)c1	C13H18FNO	unknown
+CC1NC(C)(C)COC1c1cccc(Br)c1	C13H18BrNO	unknown
+CC1C(c2cccc(Cl)c2)OCC(C)(C)N1C	C14H20ClNO	unknown
+CCN1C(C)C(c2cccc(Cl)c2)OCC1(C)C	C15H22ClNO	unknown
+CCCN1C(C)C(c2cccc(Cl)c2)OCC1(C)C	C16H24ClNO	unknown
+CCC1NC(C)(C)COC1c1cccc(Cl)c1	C14H20ClNO	unknown
+CCCC1NC(C)(C)COC1c1cccc(Cl)c1	C15H22ClNO	unknown
+C[C@H]1CNCCc2ccc(Cl)cc21	C11H14ClN	unknown
+COc1cc2c(cc1Br)C(C)CNCC2	C12H16BrNO	unknown
+COc1ccc2c(c1)CCNCC2C	C12H17NO	unknown
+COc1cc2c(cc1Cl)C(C)CNCC2	C12H16ClNO	unknown
+COc1cc2c(cc1I)C(C)CNCC2	C12H16INO	unknown
+COc1cc2c(cc1C(F)(F)F)C(C)CNCC2	C13H16F3NO	unknown
+CC1CNCCc2cc(O)c(Br)cc21	C11H14BrNO	unknown
+CCOc1cc2c(cc1Br)C(C)CNCC2	C13H18BrNO	unknown
+CC(C)Oc1cc2c(cc1Br)C(C)CNCC2	C14H20BrNO	unknown
+CC1CNCCc2cc(OCc3ccccc3)c(Br)cc21	C18H20BrNO	unknown
+COc1cc2c(cc1Br)CCNCC2	C11H14BrNO	unknown
+CCC1CNCCc2cc(OC)c(Br)cc21	C13H18BrNO	unknown
+COc1cc2c(cc1Br)C(C(C)C)CNCC2	C14H20BrNO	unknown
+CC1CNCCc2ccc(F)cc21	C11H14FN	unknown
+CC1CNCCc2ccc(Br)cc21	C11H14BrN	unknown
+CC1CNCCc2ccc(C(F)(F)F)cc21	C12H14F3N	unknown
+COc1ccc2c(c1)C(C)CNCC2	C12H17NO	unknown
+CC1CNCCc2ccccc21	C11H15N	unknown
+CC1CNCCc2c(Cl)cccc21	C11H14ClN	unknown
+CC1CNCCc2cc(Cl)ccc21	C11H14ClN	unknown
+CC1CNCCc2cccc(Cl)c21	C11H14ClN	unknown
+CC1CNCCc2c(Cl)cc(Cl)cc21	C11H13Cl2N	unknown
+CC1CNCCc2cc(Cl)c(Cl)cc21	C11H13Cl2N	unknown
+CC1CNCCc2ccc(Cl)c(Cl)c21	C11H13Cl2N	unknown
+CC1CNCCc2cc(F)c(Cl)cc21	C11H13ClFN	unknown
+CC1CNCCc2ccc(Cl)c(F)c21	C11H13ClFN	unknown
+Clc1ccc2c(c1)CCNCC2	C10H12ClN	unknown
+CCC(=O)n1cc2c3c(cccc31)C1=C[C@@H](C(=O)N(CC)CC)CN(C)[C@@H]1C2	C23H29N3O2	tryptamine
+CC(Cc1ccccc1)NC(C)c1ccccc1	C17H21N	unknown
+CC(Cc1ccccc1)N(C)C(C)c1ccccc1	C18H23N	unknown
+CC(Cc1ccccc1)N(C=O)C(C)c1ccccc1	C18H21NO	unknown
+CCN(CC)CCNCc1cc([N+](=O)[O-])c(N(C)C)cc1OC	C16H28N4O3	unknown
+CNC(C)Cc1cccc(O)c1OC	C11H17NO2	unknown
+COc1c(O)cccc1CC(C)N	C10H15NO2	unknown
+COc1ccc(O)cc1CC(C)N	C10H15NO2	unknown
+CCOc1ccc(CC(C)NC(C)=O)cc1	C13H19NO2	unknown
+CCCOc1ccc(CC(C)NC(C)=O)cc1	C14H21NO2	unknown
+CC(=O)NC(C)Cc1ccc(OCc2ccccc2)cc1	C18H21NO2	unknown
+CC(=O)NC(C)Cc1ccc(C(C)=O)cc1	C13H17NO2	unknown
+CCOc1ccc(CC(C)NC(C)C(C)=O)cc1	C15H23NO2	unknown
+CCOc1ccc(CC(C)/N=C(\C)C(C)=O)cc1	C15H21NO2	unknown
+COc1cc(OC)c(OC)cc1CC(C)NC(C)=O	C14H21NO4	unknown
+CCOc1cc(OC)c(CC(C)NC(C)=O)cc1OC	C15H23NO4	unknown
+CCCOc1cc(OC)c(CC(C)NC(C)=O)cc1OC	C16H25NO4	unknown
+COc1cc(SC)c(OC)cc1CC(C)NC(C)=O	C14H21NO3S	unknown
+COc1ccc(OC)c(CC(C)NC(C)=O)c1	C13H19NO3	unknown
+COc1cc(S(C)=O)c(OC)cc1CC(C)N	C12H19NO3S	unknown
+COc1cc(OCC(C)O)c(OC)cc1CC(C)NC(C)=O	C16H25NO5	unknown
+COc1cc(OCCCO)c(OC)cc1CC(C)NC(C)=O	C16H25NO5	unknown
+CCCN(CCC)CCc1cccc2[nH]ccc12	C16H24N2	unknown
+CCCNCCc1cccc2[nH]ccc12	C13H18N2	unknown
+CCCN(C)CCc1cccc2[nH]ccc12	C14H20N2	unknown
+CCCCN(CCC)CCc1cccc2[nH]ccc12	C17H26N2	unknown
+CCCCN(CCCC)CCc1cccc2[nH]ccc12	C18H28N2	unknown
+C=CCN(CCC)CCc1cccc2[nH]ccc12	C16H22N2	unknown
+c1ccc(CCNCCc2cccc3[nH]ccc23)cc1	C18H20N2	unknown
+CCCN(CCc1ccccc1)CCc1cccc2[nH]ccc12	C21H26N2	unknown
+CN(C)CCc1cccc2[nH]ccc12	C12H16N2	unknown
+c1cc(CCN2CCCCC2)c2cc[nH]c2c1	C15H20N2	unknown
+c1cc(CCN2CCOCC2)c2cc[nH]c2c1	C14H18N2O	unknown
+c1cc(CCN2CCCC2)c2cc[nH]c2c1	C14H18N2	unknown
+CCCN(CCC)C1CCc2ccc3[nH]ccc3c2C1	C18H26N2	unknown
+CCCN(CCC)CCc1ccc2cc[nH]c2c1	C16H24N2	unknown
+CCCN(CCC)C1CCc2cc3cc[nH]c3cc2C1	C18H26N2	unknown
+CCCN(CCC)CCc1cccc(NC(C)=O)c1	C16H26N2O	unknown
+CCCN(CCC)CCc1cccc(NC(=O)C(F)(F)F)c1	C16H23F3N2O	unknown
+CCCN(CCC)CCc1cccc(NS(C)(=O)=O)c1	C15H26N2O2S	unknown
+CCCN(CCC)C1CCc2ccc(NC(=O)C(F)(F)F)cc2C1	C18H25F3N2O	unknown
+CCCN(CCC)C1CCc2ccc(NS(C)(=O)=O)cc2C1	C17H28N2O2S	unknown
+CC(Cc1ccccc1)NCCC#N	C12H16N2	unknown
+Cc1cccc(C)c1CC(C)N	C11H17N	unknown
+CNCc1ccccc1	C8H11N	unknown
+Cc1ccc(C)c(C(O)C(C)NC(C)C)c1	C14H23NO	unknown
+CCCCCCC(C(=O)c1ccc(OC)cc1)N1CCCC1	C19H29NO2	beta-ketone
+C=COc1c(OC)cc(CCN)cc1OC	C12H17NO3	unknown
+CCCCCCC(C(=O)c1ccc(F)cc1)N1CCCC1	C18H26FNO	beta-ketone
+CCCCCC(C(=O)c1ccc(F)cc1)N1CCCC1	C17H24FNO	beta-ketone
+CCC(C(=O)c1cccs1)N1CCCC1	C12H17NOS	unknown
+CCCCCC(C(=O)c1ccccc1)N1CCCC1	C17H25NO	beta-ketone
+COc1cc(CCN)c(O)cc1Br	C9H12BrNO2	unknown
+O=C(NCC1(N2CCCCC2)CCCCC1)c1ccc(Cl)c(Cl)c1	C19H26Cl2N2O	unknown
+c1ccc(CC(c2ccccc2)N2CCN(C3CCCCC3)CC2)cc1	C24H32N2	unknown
+CCC(NC)C(=O)c1ccc(OC)c(O)c1	C12H17NO3	beta-ketone
+CCC(NC)C(=O)c1ccc(O)c(OC)c1	C12H17NO3	beta-ketone
+CCC(NC)C(O)c1ccc2c(c1)OCO2	C12H17NO3	unknown
+CCNC(C)C(O)c1ccc2c(c1)OCO2	C12H17NO3	unknown
+CCNC(C)C(=O)c1ccc(O)c(OC)c1	C12H17NO3	beta-ketone
+CCNC(C)C(=O)c1ccc(OC)c(O)c1	C12H17NO3	beta-ketone
+COc1ccc(I)c(CC(C)N)c1OC	C11H16INO2	unknown
+COc1cc(I)c(CC(C)N)cc1OC	C11H16INO2	unknown
+COc1c(I)cc(CC(C)N)c(OC)c1OC	C12H18INO3	unknown
+COc1cc(OC)c(OC)c(CC(C)N)c1I	C12H18INO3	unknown
+COc1cc(I)c(OC)c(CC(C)N)c1OC	C12H18INO3	unknown
+COc1cc(OC)c(CC(C)N)c(OC)c1I	C12H18INO3	unknown
+COc1cc(CC(C)N)c(I)c(OC)c1OC	C12H18INO3	unknown
+CC(Cc1ccc(Cl)cc1)NO	C9H12ClNO	unknown
+Cc1ccc(CC(C)NO)cc1	C10H15NO	unknown
+ONC1CCc2ccccc2C1	C10H13NO	unknown
+CONC(C)Cc1ccccc1	C10H15NO	unknown
+CONC(C)Cc1ccc(OC)cc1	C11H17NO2	unknown
+CONC(C)Cc1ccc(Cl)cc1	C10H14ClNO	unknown
+CONC(C)Cc1ccc(C)cc1	C11H17NO	unknown
+CONC(C)Cc1ccc(OC)c(OC)c1	C12H19NO3	unknown
+COc1ccc(CCCN)cc1OC	C11H17NO2	unknown
+CCN(CC)c1ccc(CCN)cc1	C12H20N2	unknown
+NCCc1cc2c3c(c1)CCCN3CCC2	C14H20N2	unknown
+CC(N)Cc1c2c(c(CO)c3c1OCC3)OCC2	C14H19NO3	unknown
+COCc1c2c(c(C[C@@H](C)N)c3c1OCC3)OCC2	C15H21NO3	unknown
+COCCOCc1c2c(c(CC(C)N)c3c1OCC3)OCC2	C17H25NO4	unknown
+CCOC(=O)COCc1c2c(c(CC(C)N)c3c1OCC3)OCC2	C18H25NO5	unknown
+COC(=O)c1c2c(c(CC(C)N)c3c1OCC3)OCC2	C15H19NO4	unknown
+COC(=O)CCc1c2c(c(CC(C)N)c3c1OCC3)OCC2	C17H23NO4	unknown
+CC(N)Cc1c2c(c(CC(=O)O)c3c1OCC3)OCC2	C15H19NO4	unknown
+CC(N)Cc1c2c(c(CCC(=O)O)c3c1OCC3)OCC2	C16H21NO4	unknown
+Cc1noc(-c2c3c(c(CC(C)N)c4c2OCC4)OCC3)n1	C16H19N3O3	unknown
+Cc1noc(Cc2c3c(c(CC(C)N)c4c2OCC4)OCC3)n1	C17H21N3O3	unknown
+Cc1noc(CCc2c3c(c(CC(C)N)c4c2OCC4)OCC3)n1	C18H23N3O3	unknown
+Cc1noc(Cc2c3ccoc3c(CC(C)N)c3ccoc23)n1	C17H17N3O3	unknown
+CC(N)Cc1c2ccoc2c(CO)c2ccoc12	C14H15NO3	unknown
+COCc1c2ccoc2c(C[C@@H](C)N)c2ccoc12	C15H17NO3	unknown
+CC(N)C(O)c1c2ccoc2c(Br)c2ccoc12	C13H12BrNO3	unknown
+COc1cc(CN)cc(OC)c1OC	C10H15NO3	unknown
+CNCc1cc(OC)c(OC)c(OC)c1	C11H17NO3	unknown
+CC(Cc1c[nH]c2ccccc12)NO	C11H14N2O	tryptamine
+CN1C[C@H](CNC(=O)c2cnccn2)C[C@@H]2c3cccc4[nH]cc(c34)C[C@H]21	C21H23N5O	unknown
+CCOC(=O)NC[C@@H]1C[C@@H]2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C19H25N3O2	unknown
+CCOC(=O)NC[C@@H]1C[C@@H]2c3cccc4c3c(cn4C)C[C@H]2N(C)C1	C20H27N3O2	unknown
+CCOC(=O)N(C)C[C@@H]1C[C@@H]2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C20H27N3O2	unknown
+CCOC(=O)NC[C@H]1CN(C)[C@@H]2Cc3c[nH]c4cccc(c34)[C@@]2(O)C1	C19H25N3O3	unknown
+CCCOC(=O)NC[C@@H]1C[C@@H]2c3cccc4c3c(cn4C)C[C@H]2N(C)C1	C21H29N3O2	unknown
+CCCCOC(=O)NC[C@@H]1C[C@@H]2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C21H29N3O2	unknown
+CCCCOC(=O)NC[C@@H]1C[C@@H]2c3cccc4c3c(cn4C)C[C@H]2N(C)C1	C22H31N3O2	unknown
+NC(Cc1c[nH]c2ccccc12)C(F)(F)F	C11H11F3N2	tryptamine
+NCCCc1c[nH]c2ccccc12	C11H14N2	unknown
+NCCCCc1c[nH]c2ccccc12	C12H16N2	unknown
+C[N+](C)(C)[C@@H](Cc1c[nH]c2ccccc12)C(=O)[O-]	C14H18N2O2	tryptamine
+CN[C@@H](Cc1c[nH]c2ccccc12)C(=O)O	C12H14N2O2	tryptamine
+CCC1(C)NCCc2c1[nH]c1ccccc21	C14H18N2	unknown
+CCC1(CC)NCCc2c1[nH]c1ccccc21	C15H20N2	unknown
+CC1(C)NCCc2c1[nH]c1ccccc21	C13H16N2	unknown
+CCCC1(C)NCCc2c1[nH]c1ccccc21	C15H20N2	unknown
+CC1CCCC2(C1)NCCc1c2[nH]c2ccccc12	C17H22N2	unknown
+c1ccc2c3c([nH]c2c1)C1(CCCCC1)NCC3	C16H20N2	unknown
+Cc1cc2c(CCN(C)C)c[nH]c2c(C)c1C	C15H22N2	tryptamine
+CN(C)CCc1cn(C)c2ccc(O)cc12	C13H18N2O	tryptamine
+COc1cc(CCNCc2cc3ccccc3o2)c(OC)cc1Br	C19H20BrNO3	unknown
+COc1cc(CCNCc2cccc(C#N)c2O)c(OC)cc1Br	C18H19BrN2O3	unknown
+COc1ccc(OC)c(CC2Cc3ccccc3CN2)c1	C18H21NO2	unknown
+COc1ccc(OC)c(C2CCCNC2)c1	C13H19NO2	unknown
+COc1cc(C2CCCNC2)c(OC)cc1Br	C13H18BrNO2	unknown
+COc1ccc(OC)c(-c2ccc(Cl)nc2)c1	C13H12ClNO2	unknown
+COc1ccc(OC)c(-c2ccc(-c3ccccc3OC)nc2)c1	C20H19NO3	unknown
+COc1cc(CCNCc2cc(COC(c3ccccc3)(c3ccccc3)c3ccccc3)ccc2OC)c(OC)cc1Br	C38H38BrNO4	unknown
+COc1cc(CCNCc2cc(CCOC(c3ccccc3)(c3ccccc3)c3ccccc3)ccc2OC)c(OC)cc1Br	C39H40BrNO4	unknown
+COc1ccc(OC(C)C)c(CCN)c1	C12H19NO2	unknown
+COc1cc(CCN)c(OC(C)C)cc1I	C12H18INO2	unknown
+COc1cc(CCNCc2ccccc2OC(C)C)c(OC(C)C)cc1I	C22H30INO3	unknown
+COc1cc(CCNCc2ccccc2O)c(O)cc1I	C16H18INO3	unknown
+COc1ccc2c(c1)CN(C)CC2c1ccc(Cl)c(Cl)c1	C17H17Cl2NO	unknown
+CN1Cc2c(N)cccc2C(c2ccccc2)C1	C16H18N2	unknown
+CN(C)CCc1c[nH]c2ccc(Cl)cc12	C12H15ClN2	tryptamine
+CN(C)CCc1c[nH]c2cc(Cl)ccc12	C12H15ClN2	tryptamine
+NCCc1c[nH]c2cc(Cl)ccc12	C10H11ClN2	tryptamine
+C(=N/CCc1c[nH]c2ccccc12)\c1ccccc1	C17H16N2	tryptamine
+COc1cc(CC(N)C(=O)O)ccc1O	C10H13NO4	unknown
+COc1ccc(CC(N)C(=O)O)cc1O	C10H13NO4	unknown
+COc1cc(CC(N)C(=O)O)cc(O)c1O	C10H13NO5	unknown
+c1ccc2c(c1)CCC1NCCOC21	C12H15NO	unknown
+c1ccc(COc2cccc3[nH]c4c(c23)CCNC4)cc1	C18H18N2O	unknown
+CN1CCc2c([nH]c3cccc(OCc4ccccc4)c23)C1	C19H20N2O	unknown
+CC1NCCc2c1[nH]c1cccc(OCc3ccccc3)c21	C19H20N2O	unknown
+CC1c2[nH]c3cccc(OCc4ccccc4)c3c2CCN1C	C20H22N2O	unknown
+COc1cc(CC(C)NCC2CC2)c(OC)cc1C	C16H25NO2	unknown
+CC(N)Cc1c[nH]c2ccc(OCc3cccs3)cc12	C16H18N2OS	tryptamine
+CC(N)Cc1c[nH]c2ccc(OCc3ccsc3)cc12	C16H18N2OS	tryptamine
+Cc1ccc(C2OC(N)=NC2C)cc1	C11H14N2O	unknown
+CC(N)Cc1c[nH]c2ccc(OCc3ccccn3)cc12	C17H19N3O	tryptamine
+CC(N)Cc1c[nH]c2ccc(OCc3cccnc3)cc12	C17H19N3O	tryptamine
+CC(N)Cc1c[nH]c2ccc(OCc3ccncc3)cc12	C17H19N3O	tryptamine
+CC(N)Cc1c[nH]c2ccc(OCc3ccccc3)cc12	C18H20N2O	tryptamine
+CC(N)Cc1c[nH]c2ccc(OCc3ccccc3C(F)(F)F)cc12	C19H19F3N2O	tryptamine
+CC(N)Cc1c[nH]c2ccc(OCc3cccc(C(F)(F)F)c3)cc12	C19H19F3N2O	tryptamine
+CC(N)Cc1c[nH]c2ccc(OCc3ccc(C(F)(F)F)cc3)cc12	C19H19F3N2O	tryptamine
+CC(N)Cc1c[nH]c2ccc(OCc3ccccc3F)cc12	C18H19FN2O	tryptamine
+CC(N)Cc1c[nH]c2ccc(OCc3cccc(F)c3)cc12	C18H19FN2O	tryptamine
+CC(N)Cc1c[nH]c2ccc(OCc3ccc(F)cc3)cc12	C18H19FN2O	tryptamine
+Cc1ccccc1COc1ccc2[nH]cc(CC(C)N)c2c1	C19H22N2O	tryptamine
+Cc1cccc(COc2ccc3[nH]cc(CC(C)N)c3c2)c1	C19H22N2O	tryptamine
+Cc1ccc(COc2ccc3[nH]cc(CC(C)N)c3c2)cc1	C19H22N2O	tryptamine
+COc1ccccc1COc1ccc2[nH]cc(CC(C)N)c2c1	C19H22N2O2	tryptamine
+COc1cccc(COc2ccc3[nH]cc(CC(C)N)c3c2)c1	C19H22N2O2	tryptamine
+COc1ccc(COc2ccc3[nH]cc(CC(C)N)c3c2)cc1	C19H22N2O2	tryptamine
+C=CCOc1ccc2[nH]cc(CC(C)N)c2c1	C14H18N2O	tryptamine
+C=C/C=C/COc1ccc2[nH]cc(CC(C)N)c2c1	C16H20N2O	tryptamine
+CC(N)Cc1c[nH]c2ccc(OCC3CCCCC3)cc12	C18H26N2O	tryptamine
+CC(N)Cc1c[nH]c2ccc(OCCc3cccs3)cc12	C17H20N2OS	tryptamine
+CC(N)Cc1c[nH]c2ccc(OCCc3ccsc3)cc12	C17H20N2OS	tryptamine
+CC(N)Cc1c[nH]c2ccc(OCCc3ccccc3)cc12	C19H22N2O	tryptamine
+CC(N)Cc1c[nH]c2ccc(OC(C)c3ccccc3)cc12	C19H22N2O	tryptamine
+CC(N)Cc1c[nH]c2ccc(OC(c3ccccc3)c3ccccc3)cc12	C24H24N2O	tryptamine
+CC(N)Cc1c[nH]c2cccc(OCc3ccccc3)c12	C18H20N2O	tryptamine
+CC(N)Cc1c[nH]c2cc(OCc3ccccc3)ccc12	C18H20N2O	tryptamine
+CC(N)Cc1c[nH]c2c(OCc3ccccc3)cccc12	C18H20N2O	tryptamine
+CC(N)Cc1cn(C)c2ccc(OCc3ccccc3)cc12	C19H22N2O	tryptamine
+CCNC(C)Cc1c[nH]c2ccc(OCc3ccccc3)cc12	C20H24N2O	tryptamine
+CCCNC(C)Cc1c[nH]c2ccc(OCc3ccccc3)cc12	C21H26N2O	tryptamine
+CC(C)NC(C)Cc1c[nH]c2ccc(OCc3ccccc3)cc12	C21H26N2O	tryptamine
+CC(Cc1c[nH]c2ccc(OCc3ccccc3)cc12)N(C)C	C20H24N2O	tryptamine
+CCN(CC)C(C)Cc1c[nH]c2ccc(OCc3ccccc3)cc12	C22H28N2O	tryptamine
+CCCN(CCC)C(C)Cc1c[nH]c2ccc(OCc3ccccc3)cc12	C24H32N2O	tryptamine
+CCC(N)Cc1c[nH]c2ccc(OCc3ccccc3)cc12	C19H22N2O	tryptamine
+NC(Cc1c[nH]c2ccc(OCc3ccccc3)cc12)c1ccccc1	C23H22N2O	tryptamine
+CC(CN)c1c[nH]c2ccc(OCc3ccccc3)cc12	C18H20N2O	tryptamine
+NCC(c1ccccc1)c1c[nH]c2ccc(OCc3ccccc3)cc12	C23H22N2O	tryptamine
+NCCc1c[nH]c2ccc(OCc3cccs3)cc12	C15H16N2OS	tryptamine
+NCCc1c[nH]c2ccc(OCc3ccsc3)cc12	C15H16N2OS	tryptamine
+COc1ccccc1COc1ccc2[nH]cc(CCN)c2c1	C18H20N2O2	tryptamine
+COc1cccc(COc2ccc3[nH]cc(CCN)c3c2)c1	C18H20N2O2	tryptamine
+COc1ccc(COc2ccc3[nH]cc(CCN)c3c2)cc1	C18H20N2O2	tryptamine
+NCCc1c[nH]c2ccc(OCc3ccccc3C(F)(F)F)cc12	C18H17F3N2O	tryptamine
+NCCc1c[nH]c2ccc(OCc3cccc(C(F)(F)F)c3)cc12	C18H17F3N2O	tryptamine
+NCCc1c[nH]c2ccc(OCc3ccc(C(F)(F)F)cc3)cc12	C18H17F3N2O	tryptamine
+CCCOc1ccc2[nH]cc(CCN)c2c1	C13H18N2O	tryptamine
+CC(C)Oc1ccc2[nH]cc(CCN)c2c1	C13H18N2O	tryptamine
+CCCCCOc1ccc2[nH]cc(CCN)c2c1	C15H22N2O	tryptamine
+CCCCCCOc1ccc2[nH]cc(CCN)c2c1	C16H24N2O	tryptamine
+NCCc1c[nH]c2ccc(OCC3CCCC3)cc12	C16H22N2O	tryptamine
+NCCc1c[nH]c2ccc(OC3CCCCC3)cc12	C16H22N2O	tryptamine
+NCCc1c[nH]c2ccc(OCC3CCCCC3)cc12	C17H24N2O	tryptamine
+CCOc1ccc2[nH]cc(CCNC)c2c1	C13H18N2O	tryptamine
+CCCOc1ccc2[nH]cc(CCNC)c2c1	C14H20N2O	tryptamine
+CNCCc1c[nH]c2ccc(OC(C)C)cc12	C14H20N2O	tryptamine
+CCCCCOc1ccc2[nH]cc(CCNC)c2c1	C16H24N2O	tryptamine
+CCCCCCOc1ccc2[nH]cc(CCNC)c2c1	C17H26N2O	tryptamine
+CNCCc1c[nH]c2ccc(OC3CCCC3)cc12	C16H22N2O	tryptamine
+CNCCc1c[nH]c2ccc(OCC3CCCC3)cc12	C17H24N2O	tryptamine
+CNCCc1c[nH]c2ccc(OCC3CCCCC3)cc12	C18H26N2O	tryptamine
+CNCCc1c[nH]c2ccc(OCc3ccccc3)cc12	C18H20N2O	tryptamine
+CCN(CC)CCc1c[nH]c2ccc(OC(C)C)cc12	C17H26N2O	tryptamine
+CCCCCOc1ccc2[nH]cc(CCN(CC)CC)c2c1	C19H30N2O	tryptamine
+CCN(CC)CCc1c[nH]c2ccc(OCC3CCCCC3)cc12	C21H32N2O	tryptamine
+CCN(CC)CCc1c[nH]c2ccc(OCc3ccccc3)cc12	C21H26N2O	tryptamine
+CCOc1ccc2[nH]cc(CCN3CCCC3)c2c1	C16H22N2O	tryptamine
+CCCOc1ccc2[nH]cc(CCN3CCCC3)c2c1	C17H24N2O	tryptamine
+CC(C)Oc1ccc2[nH]cc(CCN3CCCC3)c2c1	C17H24N2O	tryptamine
+c1ccc(COc2ccc3[nH]cc(CCN4CCCC4)c3c2)cc1	C21H24N2O	tryptamine
+CCOc1ccc2[nH]cc(CCN3CCCCC3)c2c1	C17H24N2O	tryptamine
+CC(C)Oc1ccc2[nH]cc(CCN3CCCCC3)c2c1	C18H26N2O	tryptamine
+CCNCCc1cn(Cc2ccccc2)c2ccc(OC)cc12	C20H24N2O	tryptamine
+CCN(CC)CCc1cn(Cc2ccccc2)c2ccc(OC)cc12	C22H28N2O	tryptamine
+CC[N+](C)(CC)CCc1c[nH]c2ccc(OCc3ccccc3)cc12	C22H29N2O	tryptamine
+CN(C)CCc1c[nH]c2ccc(C(N)=O)cc12	C13H17N3O	tryptamine
+CCN(CC)CCc1c[nH]c2ccc(C(N)=O)cc12	C15H21N3O	tryptamine
+CCCN(CCC)CCc1c[nH]c2ccc(C(N)=O)cc12	C17H25N3O	tryptamine
+CC(C)N(CCc1c[nH]c2ccc(C(N)=O)cc12)C(C)C	C17H25N3O	tryptamine
+NC(=O)c1ccc2[nH]cc(CCN3CCCC3)c2c1	C15H19N3O	tryptamine
+NC(=O)c1ccc2[nH]cc(CCN3CCCCC3)c2c1	C16H21N3O	tryptamine
+NC(=O)c1ccc2[nH]cc(CCN3CCOCC3)c2c1	C15H19N3O2	tryptamine
+NC(=O)c1ccc2[nH]cc(CCN3CCN(c4ccccc4)CC3)c2c1	C21H24N4O	tryptamine
+NC(=O)c1ccc2[nH]cc(CCN3CCN(Cc4ccccc4)CC3)c2c1	C22H26N4O	tryptamine
+CNCCc1c[nH]c2ccc(C(N)=O)cc12	C12H15N3O	tryptamine
+CCNCCc1c[nH]c2ccc(C(N)=O)cc12	C13H17N3O	tryptamine
+CC(C)NCCc1c[nH]c2ccc(C(N)=O)cc12	C14H19N3O	tryptamine
+CCCCNCCc1c[nH]c2ccc(C(N)=O)cc12	C15H21N3O	tryptamine
+CC(C)(C)NCCc1c[nH]c2ccc(C(N)=O)cc12	C15H21N3O	tryptamine
+CNC(=O)c1ccc2[nH]cc(CCN)c2c1	C12H15N3O	tryptamine
+CN(C)C(=O)c1ccc2[nH]cc(CCN)c2c1	C13H17N3O	tryptamine
+COC(=O)c1ccc2[nH]cc(CCN)c2c1	C12H14N2O2	tryptamine
+CCOC(=O)c1ccc2[nH]cc(CCN)c2c1	C13H16N2O2	tryptamine
+CC(=O)c1ccc2[nH]cc(CCN(C)C)c2c1	C14H18N2O	tryptamine
+CC(=O)c1ccc2[nH]cc(CCN3CCCC3)c2c1	C16H20N2O	tryptamine
+CC(N)Cc1c[nH]c2ccc(C(N)=O)cc12	C12H15N3O	tryptamine
+CCC(N)Cc1c[nH]c2ccc(C(N)=O)cc12	C13H17N3O	tryptamine
+CN1CCCC1Cc1c[nH]c2ccc(C(N)=O)cc12	C15H19N3O	unknown
+NC(=O)c1ccc2[nH]cc(C3CCN(Cc4ccccc4)C3)c2c1	C20H21N3O	unknown
+CN1CCC(c2c[nH]c3ccc(C(N)=O)cc23)C1	C14H17N3O	unknown
+CN1CC=C(c2c[nH]c3ccc(C(N)=O)cc23)CC1	C15H17N3O	unknown
+Cc1[nH]c2ccc(C(N)=O)cc2c1CCN	C12H15N3O	tryptamine
+NCCc1c(-c2ccccc2)[nH]c2ccc(C(N)=O)cc12	C17H17N3O	tryptamine
+NCCc1c[nH]c2ccc(-c3ccccc3)cc12	C16H16N2	tryptamine
+N#Cc1ccc2[nH]cc(CCN)c2c1	C11H11N3	tryptamine
+CN(C)CCc1c[nH]c2ccc([Si](C)(C)C)cc12	C15H24N2Si	tryptamine
+CN1CCC(c2c[nH]c3ccc(Br)cc23)C1	C13H15BrN2	unknown
+CN1CC=C(c2c[nH]c3ccc(Br)cc23)CC1	C14H15BrN2	unknown
+CN(CCc1c[nH]c2ccc(Br)cc12)Cc1ccccc1	C18H19BrN2	tryptamine
+Cc1ccc(CC(C)NC=O)cc1	C11H15NO	unknown
+Cc1ccc(CC(C)NC(C)Cc2ccc(C)cc2)cc1	C20H27N	unknown
+CC(Cc1ccccc1)[n+]1cc(/N=C(\[O-])Nc2ccccc2)on1	C18H18N4O2	unknown
+CC(Cc1ccccc1)NCCn1cnc2c1c(=O)n(C)c(=O)n2C	C18H23N5O2	unknown
+CN(C)C(Cc1ccccc1)c1ccccc1	C16H19N	unknown
+CCNC(Cc1ccccc1)c1ccccc1	C16H19N	unknown
+CC(C)NC(Cc1ccccc1)c1ccccc1	C17H21N	unknown
+CC(C)CC(N(C)C)C1(c2ccc(Cl)cc2)CCC1	C17H26ClN	unknown
+CC(C)c1c(CN(C)C(C)Cc2ccccc2)n(C)n(-c2ccccc2)c1=O	C24H31N3O	unknown
+Cc1c(CN2CCOC(c3ccccc3)C2C)c(=O)n(-c2ccccc2)n1C	C23H27N3O2	unknown
+CNC1C2CCC(C2)C1c1ccccc1	C14H19N	unknown
+CCNC1C2CCC(C2)C1c1ccccc1	C15H21N	unknown
+C=CCC(N)Cc1ccccc1	C11H15N	unknown
+CC1C(c2ccccc2)SC(=N)N1C	C11H14N2S	unknown
+CC(N)Cc1ccc(C(C)(C)C)cc1	C13H21N	unknown
+CCNCC(C)c1ccc2c(c1)OCO2	C12H17NO2	unknown
+COc1cc(C2CC2N)c(OC)cc1Br	C11H14BrNO2	unknown
+COc1cc(C2CC2N)c(OC)cc1I	C11H14INO2	unknown
+CCOC(=O)[C@@](C)(N)Cc1ccc(O)c(O)c1	C12H17NO4	unknown
+COc1cc2c(cc1OC)CNCC2	C11H15NO2	unknown
+CCCCCNC(C)C(=O)c1ccc2c(c1)OCO2	C15H21NO3	beta-ketone
+CCCCCCNC(C)C(=O)c1ccc2c(c1)OCO2	C16H23NO3	beta-ketone
+C1=C(c2c[nH]c3ccccc23)CNCC1	C13H14N2	unknown
+COc1ccc2[nH]cc(C3=CCCNC3)c2c1	C14H16N2O	unknown
+Fc1ccc2[nH]cc(C3=CCCNC3)c2c1	C13H13FN2	unknown
+CNC(C)C(O)c1ccccc1O	C10H15NO2	unknown
+C[C@H](N)Cc1c[nH]c2ccc3c(c12)CCCO3	C14H18N2O	tryptamine
+NCCc1cccc2c1CCC2	C11H15N	unknown
+NCC1c2ccccc2Cc2cc(Br)ccc21	C15H14BrN	unknown
+NCC1c2ccccc2Cc2cc(CCc3ccccc3)ccc21	C23H23N	unknown
+CC(C)N(C)CCc1ccccc1	C12H19N	unknown
+CCCCC(=O)N(c1ccccc1)C1CCN(CCc2ccccc2)CC1	C24H32N2O	fentanyl
+NC1C2CCC(C2)C1c1ccc2c(c1)OCO2	C14H17NO2	unknown
+CCC(=O)N(c1cccc(F)c1)C1CCN(CCc2ccccc2)CC1	C22H27FN2O	fentanyl
+NCC(c1ccccc1)c1ccc(Br)cc1	C14H14BrN	unknown
+CCCCCCc1ccc(C(CN)c2ccccc2)cc1	C20H27N	unknown
+CCNC(C)Cc1ccc(OC)c(C)c1	C13H21NO	unknown
+COc1ccc(CC(C)N(C)C)cc1C	C13H21NO	unknown
+CCC(Cc1ccc(OC)c(C)c1)NC	C13H21NO	unknown
+CCNC(C)Cc1ccc(OC)cc1C	C13H21NO	unknown
+COc1ccc(CC(C)N(C)C)c(C)c1	C13H21NO	unknown
+CCC(Cc1ccc(OC)cc1C)NC	C13H21NO	unknown
+CC(NC(C)(C)C)C(=O)c1cccc(F)c1	C13H18FNO	beta-ketone
+CC(NC(C)(C)C)C(=O)c1cccc(Br)c1	C13H18BrNO	beta-ketone
+Cc1cccc(C(=O)C(C)NC(C)(C)C)c1	C14H21NO	beta-ketone
+CC(NC(C)(C)C)C(=O)c1ccc(Cl)cc1	C13H18ClNO	beta-ketone
+CC(NC(C)(C)C)C(=O)c1ccc(Br)cc1	C13H18BrNO	beta-ketone
+Cc1ccc(C(=O)C(C)NC(C)(C)C)cc1	C14H21NO	beta-ketone
+CC(NC(C)(C)C)C(=O)c1ccc(F)c(F)c1	C13H17F2NO	beta-ketone
+CC(NC(C)(C)C)C(=O)c1ccc(Cl)c(Cl)c1	C13H17Cl2NO	beta-ketone
+Cc1ccc(C(=O)C(C)NC(C)(C)C)cc1Cl	C14H20ClNO	beta-ketone
+Cc1cc(C(=O)C(C)NC(C)(C)C)ccc1Cl	C14H20ClNO	beta-ketone
+CC(NC(C)(C)C)C(=O)c1cc(F)cc(F)c1	C13H17F2NO	beta-ketone
+CC(NC(C)(C)C)C(=O)c1cc(Cl)cc(Cl)c1	C13H17Cl2NO	beta-ketone
+CCC(NC(C)(C)C)C(=O)c1cccc(Cl)c1	C14H20ClNO	beta-ketone
+CCCC(NC(C)(C)C)C(=O)c1cccc(Cl)c1	C15H22ClNO	beta-ketone
+CCCCC(NC(C)(C)C)C(=O)c1cccc(Cl)c1	C16H24ClNO	beta-ketone
+CCCCCC(NC(C)(C)C)C(=O)c1cccc(Cl)c1	C17H26ClNO	beta-ketone
+NCCc1cc(Cl)c(OCc2ccccc2)c(Cl)c1	C15H15Cl2NO	unknown
+NCCc1cc2c(cc1Cl)OCO2	C9H10ClNO2	unknown
+COc1c(Cl)ccc(Cl)c1CCN	C9H11Cl2NO	unknown
+COc1cc(CC(F)(F)F)cc(OC)c1CC(C)N	C13H18F3NO2	unknown
+COc1cc(CC(F)(F)F)cc(OC)c1CCN	C12H16F3NO2	unknown
+COc1cc(OC(F)F)cc(OC)c1CC(C)N	C12H17F2NO3	unknown
+COc1cc(OC(F)F)cc(OC)c1CCN	C11H15F2NO3	unknown
+COc1cc(CCNCc2cccc(O)c2)c(OC)cc1Br	C17H20BrNO3	unknown
+COc1ccc(OC)c(CCNCc2ccccc2F)c1	C17H20FNO2	unknown
+COc1cc(CCNCc2ccccc2OC(F)F)c(OC)cc1Br	C18H20BrF2NO3	unknown
+COc1cc(CCNCc2cc(F)ccc2OC)c(OC)cc1Br	C18H21BrFNO3	unknown
+COc1cc(CCNCc2ccc(F)cc2OC)c(OC)cc1Br	C18H21BrFNO3	unknown
+COc1cc(CCNCc2cc(F)c(F)cc2OC)c(OC)cc1Br	C18H20BrF2NO3	unknown
+COc1cc(CCNCc2ccccc2F)cc(OC)c1OC	C18H22FNO3	unknown
+COc1cc(CCNCc2ccccc2Br)c(OC)cc1I	C17H19BrINO2	unknown
+COc1cc(CCNCc2cccc(Br)c2)c(OC)cc1I	C17H19BrINO2	unknown
+COc1cc(CCNCc2ccc(Br)cc2)c(OC)cc1I	C17H19BrINO2	unknown
+COc1cccc(CNCCc2c[nH]c3ccc(OC)cc23)c1	C19H22N2O2	tryptamine
+COc1ccc2[nH]cc(CCNCc3ccccc3Br)c2c1	C18H19BrN2O	tryptamine
+COc1ccc2[nH]cc(CCNCc3cccc(Br)c3)c2c1	C18H19BrN2O	tryptamine
+COc1ccc2[nH]cc(CCNCc3cccc(F)c3)c2c1	C18H19FN2O	tryptamine
+COc1ccc2[nH]cc(CCNCc3cccc(Cl)c3)c2c1	C18H19ClN2O	tryptamine
+COc1ccc2[nH]cc(CCNCc3cccc(I)c3)c2c1	C18H19IN2O	tryptamine
+COc1ccc2[nH]cc(CCNCc3cccc(C)c3)c2c1	C19H22N2O	tryptamine
+COc1ccc2[nH]cc(CCNCc3cccc(C(F)(F)F)c3)c2c1	C19H19F3N2O	tryptamine
+COc1ccc2[nH]cc(CCNCc3cccc(SC)c3)c2c1	C19H22N2OS	tryptamine
+C=CCC(Cc1c(OC)cccc1OC)NC	C14H21NO2	unknown
+COc1cccc(CCCc2ccccc2)c1CCN	C18H23NO	unknown
+NCCc1c(F)cccc1F	C8H9F2N	unknown
+CC(N)Cc1cc(Cl)ccc1Cl	C9H11Cl2N	unknown
+NC1(Cc2c(Cl)cccc2Cl)CC1	C10H11Cl2N	unknown
+CNC1(Cc2c(Cl)cccc2Cl)CC1	C11H13Cl2N	unknown
+Cc1cccc(C)c1OC1CC1N	C11H15NO	unknown
+NC1CC1Oc1c(Cl)cccc1Cl	C9H9Cl2NO	unknown
+Cc1cccc(C)c1OCC(C)N	C11H17NO	unknown
+NCCOc1c(Cl)cccc1Cc1ccccc1	C15H16ClNO	unknown
+NCCOc1c(Cl)cc(Cl)cc1-c1ccccc1	C14H13Cl2NO	unknown
+CCC(N)Cc1cc(OC)cc(OC)c1	C12H19NO2	unknown
+COc1cc(CC(N)C(F)(F)F)cc(OC)c1	C11H14F3NO2	unknown
+C=CCC(Cc1cc(OC)cc(OC)c1)NC	C14H21NO2	unknown
+NCCc1cc(OC(F)(F)C(F)F)cc(OC(F)(F)C(F)F)c1	C12H11F8NO2	unknown
+NCC(O)c1cc(OC(F)(F)C(F)F)cc(OC(F)(F)C(F)F)c1	C12H11F8NO3	unknown
+NCC(O)c1cc(O)cc(O)c1	C8H11NO3	unknown
+NCCc1c(Cl)ccc(Cl)c1Cl	C8H8Cl3N	unknown
+NCCc1cc(Cl)cc(Cl)c1	C8H9Cl2N	unknown
+Cc1cc(C)cc(OCCNC2CC2)c1	C13H19NO	unknown
+Clc1cc(Cl)cc(OCCNC2CC2)c1	C11H13Cl2NO	unknown
+COc1cccc(CCNC(C)C)c1OC	C13H21NO2	unknown
+CCCOc1c(CCN)cccc1OCC	C13H21NO2	unknown
+CCCOc1c(CCN)cccc1OC	C12H19NO2	unknown
+CCCCOc1c(CCN)cccc1OC	C13H21NO2	unknown
+NCC(O)c1cccc(O)c1O	C8H11NO3	unknown
+CC(N)Cc1cccc(O)c1O	C9H13NO2	unknown
+Cc1cccc(CCNC(C)C)c1O	C12H19NO	unknown
+COc1cccc(CCNC(C)C)c1O	C12H19NO2	unknown
+COc1cccc(CCN)c1C(C)C	C12H19NO	unknown
+CCOc1cccc(CCN)c1CCC(C)C	C15H25NO	unknown
+CC(C)NCCc1cccc(O)c1O	C11H17NO2	unknown
+NCc1cccc2ccccc12	C11H11N	unknown
+CC(N)c1cccc2ccccc12	C12H13N	unknown
+CCCC(N)c1cccc2ccccc12	C14H17N	unknown
+COc1ccc2cccc(CCNC(C)=O)c2c1	C15H17NO2	unknown
+Cc1coc2cccc(CC(C)N)c12	C12H15NO	unknown
+CC(N)Cc1scc(Cl)c1Cl	C7H9Cl2NS	unknown
+CC(N)Cc1scc2c1OCO2	C8H11NO2S	unknown
+COc1cc(CCCC2CC2)ccc1CCN	C15H23NO	unknown
+COc1ccc(CCNC(C)C)c(O)c1	C12H19NO2	unknown
+NCCc1ccc(O)cc1F	C8H10FNO	unknown
+CC(N)Cc1ccc(C(F)(F)F)cc1F	C10H11F4N	unknown
+NCCc1ccc(Cl)cc1Cl	C8H9Cl2N	unknown
+CC(N)Cc1ccc(N(C)C)cc1Cl	C11H17ClN2	unknown
+CCC(N)Cc1ccc(N(C)C)cc1Cl	C12H19ClN2	unknown
+CN(C)c1ccc(CC(C)(C)N)c(Cl)c1	C12H19ClN2	unknown
+CC(N)Cc1ccc(N(C)C)cc1Br	C11H17BrN2	unknown
+COc1ccc(CC(C)N)c(C)c1	C11H17NO	unknown
+CCOc1ccc(CC(C)N)c(C)c1	C12H19NO	unknown
+Cc1cc(OC(C)C)ccc1CC(C)N	C13H21NO	unknown
+CNc1ccc(CC(C)N)c(C)c1	C11H18N2	unknown
+Cc1cc(N)ccc1CC(C)N	C10H16N2	unknown
+NCCc1ccc(N)cc1N	C8H13N3	unknown
+NCCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	C8H9N3O4	unknown
+Cc1ccc(C(O)C(C)NC(C)C)c(C)c1	C14H23NO	unknown
+COc1ccc(C(O)C(C)N)c(OC)c1	C11H17NO3	unknown
+CCN(CC)CCOc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	C12H17N3O5	unknown
+CCN(CC)CCOc1ccc([N+](=O)[O-])cc1O	C12H18N2O4	unknown
+CCN(CC)CCOc1ccc([N+](=O)[O-])cc1Cl	C12H17ClN2O3	unknown
+NCCc1c2ccccc2cc2ccccc12	C16H15N	unknown
+COc1ccc2[nH]ccc2c1CCN	C11H14N2O	unknown
+COc1cc2cc[nH]c2cc1CCN	C11H14N2O	unknown
+COc1cc(CCN)c2[nH]ccc2c1	C11H14N2O	unknown
+COc1ccc(OC)c2c1CC2CN	C11H15NO2	unknown
+COc1ccc(OC)c2c1CCC2CN	C12H17NO2	unknown
+CCCN(CCC)C1Cc2c(OC)ccc(OC)c2C1	C17H27NO2	unknown
+CC(CNCC(=O)Nc1ccccc1C(F)(F)F)c1ccccc1	C18H19F3N2O	unknown
+COc1ccc2c(c1)CC(N)CCO2	C11H15NO2	unknown
+Oc1c(Br)cc(Br)cc1CNCCc1c[nH]c2ccccc12	C17H16Br2N2O	tryptamine
+CC(CNCc1ccc(Cl)cc1)c1ccccc1	C16H18ClN	unknown
+COc1ccc(OC(F)F)c(CCN)c1	C10H13F2NO2	unknown
+COc1ccc(OC(F)F)c(CC(C)N)c1	C11H15F2NO2	unknown
+COc1ccc(OC(F)(F)F)cc1CC(C)N	C11H14F3NO2	unknown
+CCOc1ccc(OC)c(CCN)c1	C11H17NO2	unknown
+Cc1cc(C)c(NC(=O)CNCC(C)c2ccccc2)c(C)c1	C20H26N2O	unknown
+CCc1ccc(OC)c(CCN)c1	C11H17NO	unknown
+COc1ccc(-c2ccccc2Cl)cc1CCN	C15H16ClNO	unknown
+COc1ccc(-c2ccc(C(C)C)cc2)cc1CCN	C18H23NO	unknown
+CCN(CC)C(C)Cc1cc(-c2ccc(C(F)(F)F)cc2)ccc1OC	C21H26F3NO	unknown
+COc1ccc(OCc2ccccc2)c(CC(C)N)c1	C17H21NO2	unknown
+COc1ccc(O)c(CCNC(C)C)c1	C12H19NO2	unknown
+NCC(O)c1cc(O)ccc1O	C8H11NO3	unknown
+NCCc1cc(N)ccc1O	C8H12N2O	unknown
+NCCc1ccc(O)c(CCN)c1	C10H16N2O	unknown
+NCCc1cc(OCc2ccccc2)ccc1F	C15H16FNO	unknown
+NCCc1cc(O)ccc1F	C8H10FNO	unknown
+CS(=O)(=O)Nc1ccc(F)c(C(O)CN)c1	C9H13FN2O3S	unknown
+NCCc1cc(Cl)ccc1Cl	C8H9Cl2N	unknown
+CC(N)Cc1cc(C(F)(F)F)ccc1Cl	C10H11ClF3N	unknown
+NCCc1cc(O)ccc1I	C8H10INO	unknown
+COc1ccc(OC)c(C(=O)N2CCNCC2)c1	C13H18N2O3	unknown
+COc1cc(CC(C)N)c(OC)s1	C9H15NO2S	unknown
+COc1sc(Br)cc1CC(C)N	C8H12BrNOS	unknown
+COc1cc(CCN)c(SC)s1	C8H13NOS2	unknown
+COc1sc(SC)cc1CC(C)N	C9H15NOS2	unknown
+CCc1cc(CCN)c(SC)s1	C9H15NS2	unknown
+CNCC[C@@H](Oc1ccccc1C)c1ccccc1	C17H21NO	unknown
+Clc1ccc([C@]23CNC[C@H]2C3)cc1Cl	C11H11Cl2N	unknown
+COc1ccc(CC(C)NN)cc1OC	C11H18N2O2	unknown
+COc1ccc(CC(N)C(F)(F)F)cc1OC	C11H14F3NO2	unknown
+COc1cc(CCN)ccc1OCCN(C)C	C13H22N2O2	unknown
+COc1cc(CC(C)N)ccc1OCCN(C)C	C14H24N2O2	unknown
+COc1cc(CCN)ccc1OCC[N+](C)(C)C	C14H25N2O2	unknown
+COc1cc(CC(C)N)ccc1OCC[N+](C)(C)C	C15H27N2O2	unknown
+COc1cc(CCN)ccc1F	C9H12FNO	unknown
+COc1cc(CC(C)N)ccc1I	C10H14INO	unknown
+CCCNCCc1ccc(O)c(O)c1	C11H17NO2	unknown
+NC(Cc1ccc(O)c(O)c1)C(F)F	C9H11F2NO2	unknown
+NCCc1ccc(F)c(O)c1	C8H10FNO	unknown
+Cc1ccc(CC(C)N)cc1O	C10H15NO	unknown
+CCC(N)Cc1ccc(C)c(O)c1	C11H17NO	unknown
+CCc1ccc(CC(C)N)cc1O	C11H17NO	unknown
+CC(C)NC(=O)NCC(C)c1ccccc1	C13H20N2O	unknown
+CC(N)Cc1ccc(Cl)c(O)c1	C9H12ClNO	unknown
+CC(N)Cc1ccc(I)c(O)c1	C9H12INO	unknown
+NCCc1ccc(O)c(S)c1	C8H11NOS	unknown
+CCCN(CCc1ccccc1)CCc1ccc(O)c(F)c1	C19H24FNO	unknown
+C#CCN(C)C(C)Cc1ccc(Cl)c(Cl)c1	C13H15Cl2N	unknown
+NCCc1ccc(N2CCCCC2)c(Cl)c1	C13H19ClN2	unknown
+NCCc1ccc(O)c(Br)c1	C8H10BrNO	unknown
+CC(N)Cc1ccc(N(C)C)c(Br)c1	C11H17BrN2	unknown
+NCCc1ccc(O)c(I)c1	C8H10INO	unknown
+CC(N)Cc1ccc(O)c(I)c1	C9H12INO	unknown
+COc1ccc(CCN)cc1C	C10H15NO	unknown
+COc1ccc(CC(C)N)cc1C	C11H17NO	unknown
+Cc1cc(CC(C)N)ccc1N(C)C	C12H20N2	unknown
+CC(N)Cc1ccc(Oc2ccccc2)c(C(F)(F)F)c1	C16H16F3NO	unknown
+CC(=O)c1cc(CCN)ccc1O	C10H13NO2	unknown
+CC(N)Cc1ccc(Cl)c(C(F)(F)F)c1	C10H11ClF3N	unknown
+CC(Cc1ccc2c(c1)OCO2)NC(F)(F)F	C11H12F3NO2	unknown
+CC(Cc1ccc2c(c1)OCO2)NCCF	C12H16FNO2	unknown
+CC(Cc1ccc2c(c1)OCO2)NCC(F)F	C12H15F2NO2	unknown
+CC(Cc1ccc2c(c1)OCO2)N(C)CC#N	C13H16N2O2	unknown
+CC(Cc1ccc2c(c1)OCO2)Nc1ccccc1	C16H17NO2	unknown
+CCCC(CCC)NC(C)Cc1ccc2c(c1)OCO2	C17H27NO2	unknown
+CC(Cc1ccc2c(c1)OCO2)NN	C10H14N2O2	unknown
+CNC(Cc1ccc2c(c1)OCO2)C(C)C	C13H19NO2	unknown
+CNC(Cc1ccc2c(c1)OCO2)C(C)(C)C	C14H21NO2	unknown
+C=CCC(N)Cc1ccc2c(c1)OCO2	C12H15NO2	unknown
+CC(=O)Cc1ccc2c(c1)OCO2	C10H10O3	unknown
+CC(=O)Cc1ccc(O)c(O)c1	C9H10O3	unknown
+COc1cc(CC(C)=O)ccc1O	C10H12O3	unknown
+CNC(Cc1ccc2c(c1)OCO2)C1CC1	C13H17NO2	unknown
+CC(N)C(C)c1ccc2c(c1)OCO2	C11H15NO2	unknown
+CC(N)C(C)(C)c1ccc2c(c1)OCO2	C12H17NO2	unknown
+CC(N)C1(c2ccc3c(c2)OCO3)CC1	C12H15NO2	unknown
+C=C(c1ccc2c(c1)OCO2)C(C)N	C11H13NO2	unknown
+COC(c1ccc2c(c1)OCO2)C(C)N	C11H15NO3	unknown
+NCC(=O)c1ccc2c(c1)OCO2	C9H9NO3	beta-ketone
+CCCCC(C(=O)c1ccc2c(c1)OCO2)N1CCCC1	C17H23NO3	beta-ketone
+O=C(c1ccc2c(c1)OCO2)C(C1CC1)N1CCCC1	C16H19NO3	beta-ketone
+NCCc1ccc2c(c1)C(F)(F)C(F)(F)O2	C10H9F4NO	unknown
+NCCc1ccc2c(c1)OC(F)(F)C(F)(F)O2	C10H9F4NO2	unknown
+CC(N)Cc1ccc2c(c1)OCCCO2	C12H17NO2	unknown
+CC(N)Cc1ccc2c(c1)C=CC2	C12H15N	unknown
+CC(N)Cc1ccc2sccc2c1	C11H13NS	unknown
+CC(N)Cc1ccc2c(c1)CC=C2	C12H15N	unknown
+CC(N)Cc1ccc2ccsc2c1	C11H13NS	unknown
+CC(N)Cc1ccc2c(c1)N=CC2	C11H14N2	unknown
+CC(N)Cc1ccc2ocnc2c1	C10H12N2O	unknown
+CC(N)Cc1ccc2scnc2c1	C10H12N2S	unknown
+CC(N)Cc1ccc2[nH]cnc2c1	C10H13N3	unknown
+CC(N)Cc1ccc2c(c1)CC=N2	C11H14N2	unknown
+CC(N)Cc1ccc2ncoc2c1	C10H12N2O	unknown
+CC(N)Cc1ccc2ncsc2c1	C10H12N2S	unknown
+CC(N)Cc1ccc2oc(=O)oc2c1	C10H11NO3	unknown
+CC(N)Cc1ccc2c(c1)CC2	C11H15N	unknown
+NC1CC(c2ccccc2)C1	C10H13N	unknown
+NC1CC(c2ccc3c(c2)OCO3)C1	C11H13NO2	unknown
+NCC1Cc2cc3c(cc21)OCO3	C10H11NO2	unknown
+CNC(C)Cc1cc2c(s1)OCO2	C9H13NO2S	unknown
+CC(Cc1ccc2c(c1)OCO2)NC=O	C11H13NO3	unknown
+CC(=O)N(C)C(C)Cc1ccc2c(c1)OCO2	C13H17NO3	unknown
+NC(Cc1ccc2c(c1)OCO2)Cc1ccc2c(c1)OCO2	C17H17NO4	unknown
+CNC(C)Cc1ccc2c(c1F)OCO2	C11H14FNO2	unknown
+CNC(C)Cc1cc(F)c2c(c1)OCO2	C11H14FNO2	unknown
+CNC(C)Cc1cc2c(cc1F)OCO2	C11H14FNO2	unknown
+CNC(C)Cc1cc(F)c2c(c1F)OCO2	C11H13F2NO2	unknown
+CNC(C)Cc1c(F)cc2c(c1F)OCO2	C11H13F2NO2	unknown
+CNC(C)Cc1cc2c(c(F)c1F)OCO2	C11H13F2NO2	unknown
+CNC(C)Cc1c(F)c(F)c2c(c1F)OCO2	C11H12F3NO2	unknown
+CC(C)NCC(O)c1ccc2ccccc2c1	C15H19NO	unknown
+CC(N)Cc1cc2ccccc2o1	C11H13NO	unknown
+NCCc1ccc(-c2cc(CCN)ccc2O)c(O)c1	C16H20N2O2	unknown
+NCCc1ccc(O)c(O)c1O	C8H11NO3	unknown
+NCCc1ccc(O)c(O)c1F	C8H10FNO2	unknown
+COc1ccc2c(c1I)CC(N)CCO2	C11H14INO2	unknown
+COc1ccc(OC)c2c1C1CCC2C1N	C13H17NO2	unknown
+COc1ccc(CNCC(C)c2ccccc2)cc1OC	C18H23NO2	unknown
+CC(CNCc1ccccc1C#N)c1ccccc1	C17H18N2	unknown
+COc1ccc2c3c1C(CN)CCCC3CO2	C14H19NO2	unknown
+CCOc1cc(OC)c(CCN)c(OC)c1	C12H19NO3	unknown
+C=CCOc1cc(OC)c(CCN)c(OC)c1	C13H19NO3	unknown
+C=C(C)COc1cc(OC)c(CCN)c(OC)c1	C14H21NO3	unknown
+C=CCOc1cc(OC)c(CC(C)N)c(OC)c1	C14H21NO3	unknown
+C=C(C)COc1cc(OC)c(CC(C)N)c(OC)c1	C15H23NO3	unknown
+COc1cc(C(C)C)cc(OC)c1CCN	C13H21NO2	unknown
+COc1cc(Cl)cc(OC)c1CCN	C10H14ClNO2	unknown
+C#Cc1cc(OC)c(CC(C)N)c(OC)c1	C13H17NO2	unknown
+COc1cc(Cl)cc(OC)c1CC(C)N	C11H16ClNO2	unknown
+NCCc1c([N+](=O)[O-])cc([N+](=O)[O-])cc1[N+](=O)[O-]	C8H8N4O6	unknown
+CC(N)Cc1c(Cl)cc(Br)cc1Cl	C9H10BrCl2N	unknown
+CC(N)Cc1c(Cl)cc(Cl)cc1Cl	C9H10Cl3N	unknown
+CC(N)Cc1c(Cl)cc(N(C)C)cc1Cl	C11H16Cl2N2	unknown
+COc1cc(C(C)N)cc(OC)c1OC	C11H17NO3	unknown
+COc1cc(C(C)(C)CN)cc(OC)c1OC	C13H21NO3	unknown
+COc1cc(C(C)CN)cc(OC)c1OC	C12H19NO3	unknown
+COc1cc(C(F)CN)cc(OC)c1OC	C11H16FNO3	unknown
+[2H]C(N)C([2H])c1cc(OC)c(OC)c(OC)c1	C11H17NO3	unknown
+COc1c2c(cc3c1OCO3)CCN(C)C2	C12H15NO3	unknown
+COc1cc2c(c(OC)c1OC)CCCC(N)C2	C14H21NO3	unknown
+COc1cc(CCN)cc(OC)c1Oc1ccccc1	C16H19NO3	unknown
+COc1cc(CCN)cc(OC)c1OC(C)CF	C13H20FNO3	unknown
+COc1cc(CCN)cc(OC)c1OC(C)(C)F	C13H20FNO3	unknown
+COc1cc(CCN)cc(OC)c1OC(C)C(F)(F)F	C13H18F3NO3	unknown
+COc1cc(CCN)cc(OC)c1OC(C)(C)C	C14H23NO3	unknown
+COc1cc(CCN)cc(OC)c1OCCSC	C13H21NO3S	unknown
+CCC(C)Oc1c(OC)cc(CCN)cc1OC	C14H23NO3	unknown
+COc1cc(CCN)cc(OC)c1OC(C)F	C12H18FNO3	unknown
+COc1cc(CCN)cc(OC)c1OC(C)(F)F	C12H17F2NO3	unknown
+COc1cc(CCN)cc(OC)c1OC(F)CF	C12H17F2NO3	unknown
+COc1cc(CCN)cc(OC)c1OC(F)C(F)F	C12H16F3NO3	unknown
+COc1cc(CCN)cc(OC)c1OC(F)C(F)(F)F	C12H15F4NO3	unknown
+COc1cc(CCN)cc(OC)c1OC(F)(F)CF	C12H16F3NO3	unknown
+COc1cc(CCN)cc(OC)c1OC(F)(F)C(F)F	C12H15F4NO3	unknown
+COc1cc(CCN)cc(OC)c1OC(F)(F)C(F)(F)F	C12H14F5NO3	unknown
+COc1cc(CCN)cc(OC(C)C)c1OC	C13H21NO3	unknown
+COc1cc(CCN)cc(OC(F)(F)F)c1OC	C11H14F3NO3	unknown
+NCC(O)c1cc(OC(F)(F)C(F)F)c(OC(F)(F)C(F)F)c(OC(F)(F)C(F)F)c1	C14H11F12NO4	unknown
+COc1c(OC(F)F)cc(CCN)cc1OC(F)F	C11H13F4NO3	unknown
+COc1cc(CCN)cc(OC(F)(F)F)c1OC(F)(F)F	C11H11F6NO3	unknown
+NCCc1cc(OCF)c(OCF)c(OCF)c1	C11H14F3NO3	unknown
+COc1cc(CCN)cc(SC)c1OC(F)F	C11H15F2NO2S	unknown
+COc1cc(CCN)cc(SC)c1OC(F)(F)F	C11H14F3NO2S	unknown
+COc1cc(CCN)cc(SC)c1OC(C)C	C13H21NO2S	unknown
+COc1cc(CCN)cc(SC)c1OCC(F)(F)F	C12H16F3NO2S	unknown
+C=C(F)COc1c(OC)cc(CCN)cc1SC	C13H18FNO2S	unknown
+C=C(C)COc1c(OC)cc(CCN)cc1SC	C14H21NO2S	unknown
+COc1cc(CC(C)N)cc(OC)c1I	C11H16INO2	unknown
+NCCc1cc(Br)c2c(c1)OCO2	C9H10BrNO2	unknown
+CCc1c(OC)cc(CCN)cc1OC	C12H19NO2	unknown
+C=Cc1c(OC)cc(CCN)cc1OC	C12H17NO2	unknown
+C#Cc1c(OC)cc(CCN)cc1OC	C12H15NO2	unknown
+COc1cc(CCN)cc(OC)c1C(F)(F)F	C11H14F3NO2	unknown
+CCCc1c(OC)cc(CCN)cc1OC	C13H21NO2	unknown
+C=CCc1c(OC)cc(CCN)cc1OC	C13H19NO2	unknown
+COc1cc(CCN)cc(OC)c1C(C)C	C13H21NO2	unknown
+C=C(C)Cc1c(OC)cc(CCN)cc1OC	C14H21NO2	unknown
+COc1cc(CCN)nc(OC)c1OC	C10H16N2O3	unknown
+COc1nc(CCN)nc(OC)c1OC	C9H15N3O3	unknown
+CCCCc1cc(OC)c(CCN)cc1OC	C14H23NO2	unknown
+COc1cc(C2CC2)c(OC)cc1CCN	C13H19NO2	prophetic
+C=CCc1cc(OC)c(CCN)cc1OC	C13H19NO2	prophetic
+C=C(C)c1cc(OC)c(CCN)cc1OC	C13H19NO2	unknown
+C/C=C/c1cc(OC)c(CCN)cc1OC	C13H19NO2	unknown
+C/C=C\c1cc(OC)c(CCN)cc1OC	C13H19NO2	unknown
+C#CCc1cc(OC)c(CCN)cc1OC	C13H17NO2	unknown
+COc1cc(CCN)c(OC)cc1CF	C11H16FNO2	unknown
+COc1cc(C(F)F)c(OC)cc1CCN	C11H15F2NO2	prophetic
+COc1cc(CC(F)F)c(OC)cc1CCN	C12H17F2NO2	prophetic
+C=C(F)c1cc(OC)c(CCN)cc1OC	C12H16FNO2	unknown
+COc1cc(C(C)(C)F)c(OC)cc1CCN	C13H20FNO2	unknown
+COc1cc(C(C)CF)c(OC)cc1CCN	C13H20FNO2	unknown
+COc1cc(CC(C)N)c(OC)cc1CCCF	C14H22FNO2	unknown
+COc1cc(CC(C)F)c(OC)cc1CC(C)N	C14H22FNO2	unknown
+COc1cc(C(F)F)c(OC)cc1CC(C)N	C12H17F2NO2	unknown
+COc1cc(CC(C)N)c(OC)cc1Cc1nc(C)no1	C15H21N3O3	unknown
+CCNC1(c2ccccc2)CCCCC1=O	C14H19NO	arylcycloalkylamine
+CNC(CCl)C(=O)c1ccc(C)cc1	C11H14ClNO	beta-ketone
+C=C(C)COc1cc(OC)c(CCN)cc1OC	C14H21NO3	unknown
+C=CCOc1cc(OC)c(CCN)cc1OC	C13H19NO3	unknown
+C=CCOc1cc(OC)c(CC(C)N)cc1OC	C14H21NO3	unknown
+C=C(C)COc1cc(OC)c(CC(C)N)cc1OC	C15H23NO3	unknown
+COc1cc(OCF)c(OC)cc1CC(C)N	C12H18FNO3	unknown
+COc1cc(OC(F)F)c(OC)cc1CC(C)N	C12H17F2NO3	unknown
+COc1cc(OC(F)(F)F)c(OC)cc1CC(C)N	C12H16F3NO3	unknown
+COc1cc(SCF)c(OC)cc1CCN	C11H16FNO2S	unknown
+COc1cc(SC(F)F)c(OC)cc1CCN	C11H15F2NO2S	unknown
+COc1cc(SC(F)(F)F)c(OC)cc1CCN	C11H14F3NO2S	unknown
+CCCCCSc1cc(OC)c(CCN)cc1OC	C15H25NO2S	unknown
+CCCCCCCSc1cc(OC)c(CCN)cc1OC	C17H29NO2S	unknown
+CCN(CC)Sc1cc(OC)c(CCN)cc1OC	C14H24N2O2S	unknown
+COc1cc(SC(CF)CF)c(OC)cc1CCN	C13H19F2NO2S	unknown
+C#CCSc1cc(OC)c(CCN)cc1OC	C13H17NO2S	unknown
+COc1cc(N(C)C)c(OC)cc1CCN	C12H20N2O2	unknown
+COc1cc(Br)c(OC(F)(F)F)cc1CCN	C10H11BrF3NO2	unknown
+COc1cc(CCN)c(OC(F)(F)F)cc1Br	C10H11BrF3NO2	unknown
+COc1cc(Br)c(OC(F)F)cc1CCN	C10H12BrF2NO2	unknown
+COc1cc(C(C)CN)c(OC)cc1Br	C11H16BrNO2	unknown
+CCc1cc(OC)c(CC(C)NC)cc1OC	C14H23NO2	unknown
+COc1cc(CCNCCO)c(OC)cc1Br	C12H18BrNO3	unknown
+COc1cc(CC(C)NCCO)c(OC)cc1Br	C13H20BrNO3	unknown
+COc1cc(CCNC(C#N)c2ccccc2)c(OC)cc1Br	C18H19BrN2O2	unknown
+CCOC(=O)NCCc1cc(OC)c(Br)cc1OC	C13H18BrNO4	unknown
+CCOC(=O)NC(C)Cc1cc(OC)c(Br)cc1OC	C14H20BrNO4	unknown
+COc1cc(Br)c(OC)c2c1CC(N)CC2	C12H16BrNO2	unknown
+Cc1c2c(c(C3CC3N)c3c1OCC3)OCC2	C14H17NO2	unknown
+COc1cc(N2CCNCC2)c(OC)cc1C	C13H20N2O2	unknown
+COc1cc(N2CCNCC2)c(OC)cc1Br	C12H17BrN2O2	unknown
+COc1cc(C(=O)N2CCNCC2)c(OC)cc1C	C14H20N2O3	unknown
+COc1cc2c(cc1CC(C)N)OC(C)(C)C1CCC(C)=CC21	C20H29NO2	unknown
+COc1cc(CCN)c(OC)cc1CCN	C12H20N2O2	unknown
+COc1cc(CC(C)N)c(OC)cc1Cc1cc(OC)c(CC(C)N)cc1OC	C23H34N2O4	unknown
+COc1cc(CC(C)N)c(Br)c(OC)c1OC	C12H18BrNO3	unknown
+COc1cc(Br)c(OC)c(Br)c1CC(C)N	C11H15Br2NO2	unknown
+COc1cc(OC)c(CC(C)N)c(OC)c1Br	C12H18BrNO3	unknown
+COc1cc(C(C)(C)C)c(OC)cc1CCN	C14H23NO2	unknown
+COc1cc(CC(C)N)c(OC)c2c1CCOC2	C14H21NO3	unknown
+COc1cc(CCN)c(I)c(OC)c1OC	C11H16INO3	unknown
+COc1c(Br)c2c(c(OC)c1OC)CC2CN	C12H16BrNO3	unknown
+COc1c(Br)c2c(c(OC)c1OC)CCC2CN	C13H18BrNO3	unknown
+COc1cc(CCN)c(F)c(OC)c1OC	C11H16FNO3	unknown
+COc1c(O)cc(CCN)c2c1SSSSS2	C9H11NO2S5	unknown
+COc1cc(CCN)c2c(c1O)SSS2	C9H11NO2S3	unknown
+COc1c(O)cc(CCN)c(SC)c1SC	C11H17NO2S2	unknown
+COc1c(O)cc(CCN)c2c1SSc1c(CCN)cc(O)c(OC)c1SS2	C18H22N2O4S4	unknown
+COc1cc(CCN)c2c(c1OC)SSSSS2	C10H13NO2S5	unknown
+COc1cc(CCN)c2c(c1OC)SSS2	C10H13NO2S3	unknown
+COc1cc(CCN)c2c(c1OC)SSS2=O	C10H13NO3S3	unknown
+COc1cc(CCN)c(OC)c2c1SSS2	C10H13NO2S3	unknown
+CCCCSc1c(CCN)cc(OC)c(OC)c1SCCCC	C18H31NO2S2	unknown
+CCCCSc1c(CCN)cc(OC)c(O)c1SCCCC	C17H29NO2S2	unknown
+COc1cc(CCN)c(SC(C)(C)C)c(SC(C)(C)C)c1O	C17H29NO2S2	unknown
+COc1cc(CCN)c(SCc2ccccc2)c(SCc2ccccc2)c1O	C23H25NO2S2	unknown
+COc1cc(CCN)c(F)c(F)c1OC	C10H13F2NO2	unknown
+NCCc1cc(O)c(O)c(F)c1F	C8H9F2NO2	unknown
+COc1c(F)cc(CCN)c(F)c1OC	C10H13F2NO2	unknown
+NCCc1cc(F)c(OCc2ccccc2)c(OCc2ccccc2)c1F	C22H21F2NO2	unknown
+CCCc1c(CCN)cc(F)c(OC)c1OC	C13H20FNO2	unknown
+NCCc1cc(F)c(F)c(F)c1F	C8H7F4N	unknown
+CCc1c(CCN)cc(OC)c(OC)c1OC	C13H21NO3	unknown
+COc1c(CCN)cc(O)c(O)c1Br	C9H12BrNO3	unknown
+COc1cc(CCN)c(OC)c(C)c1OC	C12H19NO3	unknown
+Cc1c(O)c(O)cc(CCN)c1O	C9H13NO3	unknown
+COc1c(C)cc(CCN)c(C)c1OC	C12H19NO2	unknown
+NCCc1cc(O)c(O)c(O)c1O	C8H11NO4	unknown
+COc1cc(CC(C)N)c(O)c(OC)c1C	C12H19NO3	unknown
+COc1c(C)cc(CC(C)N)c(C)c1C	C13H21NO	unknown
+COc1cc(Br)c(OC)c(Br)c1CCN	C10H13Br2NO2	unknown
+COc1c(Br)cc(Br)c(CCNCC(C)O)c1Br	C12H16Br3NO2	unknown
+COc1c(Br)cc(Br)c(CCN(C)CC(C)O)c1Br	C13H18Br3NO2	unknown
+CNCCc1c(Br)cc(Br)c(OC)c1Br	C10H12Br3NO	unknown
+COc1cc(Br)c(CCN)c(OC(C)C)c1OC	C13H20BrNO3	unknown
+NCCc1c(Br)cc(Br)c(O)c1Br	C8H8Br3NO	unknown
+COc1c(C)cc(Br)c(CCN)c1C	C11H16BrNO	unknown
+NCCc1c(F)cc(O)c(O)c1F	C8H9F2NO2	unknown
+NCCc1c(F)cc(F)c(F)c1F	C8H7F4N	unknown
+COc1cc(OC)c(OC)c(C)c1CCN	C12H19NO3	unknown
+Cc1c(O)c(O)cc(O)c1CCN	C9H13NO3	unknown
+Cc1cc(C(C)(C)C)c(O)c(C)c1CCN	C14H23NO	unknown
+Cc1cc(C)c(CCN)c(C)c1CCN	C13H22N2	unknown
+COc1cc(C)c(CCN)c(C)c1CCN	C13H22N2O	unknown
+CCc1cc(CC)c(CCN)c(CC)c1CCN	C16H28N2	unknown
+Cc1cc(C(C)(C)C)c(O)c(C)c1CC(C)N	C15H25NO	unknown
+NCCc1c(O)c(O)cc(O)c1O	C8H11NO4	unknown
+COc1cc(C)c(OC)c(CCN)c1C	C12H19NO2	unknown
+NCCc1c(F)c(O)cc(F)c1F	C8H8F3NO	unknown
+NCCc1c(O)c(O)cc(F)c1F	C8H9F2NO2	unknown
+NCCc1c(F)c(F)cc(F)c1F	C8H7F4N	unknown
+NCCc1c(O)c(Cl)cc(Cl)c1Cl	C8H8Cl3NO	unknown
+CC(N)Cc1c(F)c(F)cc(F)c1F	C9H9F4N	unknown
+COc1cc(F)c(F)c(CC(C)N)c1OC	C11H15F2NO2	unknown
+COc1cc(C)c(OC)c(CC(C)N)c1C	C13H21NO2	unknown
+COc1c(C)c(CCN)c(C)c(OC)c1OC	C13H21NO3	unknown
+COc1c(C)c(CCN)c(Br)c(OC)c1OC	C12H18BrNO3	unknown
+COc1c(Cl)c(CCN)c(Br)c(OC)c1OC	C11H15BrClNO3	unknown
+COc1c(C)c(C)c(OC)c(CC(C)N)c1C	C14H23NO2	unknown
+COc1c(F)c(CC(C)N)c(OC)c(F)c1Br	C11H14BrF2NO2	unknown
+COc1c(Cl)c(CC(C)N)c(OC)c(F)c1Br	C11H14BrClFNO2	unknown
+COc1c(F)c(CC(C)N)c(OC)c(C)c1Br	C12H17BrFNO2	unknown
+CCc1c(Br)c(OC)c(Cl)c(CC(C)N)c1OC	C13H19BrClNO2	unknown
+COc1c(Br)c(OC)c(CC(C)N)c(OC)c1Br	C12H17Br2NO3	unknown
+COc1c(Cl)c(Cl)c(OC)c(CCN)c1Cl	C10H12Cl3NO2	unknown
+CCCc1c(CCN)c(CCC)c(CCN)c(CCC)c1CCN	C21H39N3	unknown
+CC(C)(C)CCc1c(CCN)c(CCC(C)(C)C)c(CCN)c(CCC(C)(C)C)c1CCN	C30H57N3	unknown
+Cc1c(CCN)c(C)c(CCN)c(C)c1CCN	C15H27N3	unknown
+COc1c(C)c(OC)c(OC)c(C)c1CCN	C13H21NO3	unknown
+COc1c(C)c(OC)c(OC)c(C)c1CCN(C)C	C15H25NO3	unknown
+COc1c(C)c(CCN)c(OC)c(OC)c1OC	C13H21NO4	unknown
+Cc1c(O)c(O)c(C)c(CCN)c1O	C10H15NO3	unknown
+NCCc1c(F)c(O)c(O)c(F)c1F	C8H8F3NO2	unknown
+COc1c(F)c(F)c(CCN)c(F)c1OC	C10H12F3NO2	unknown
+NCCc1c(F)c(F)c(N)c(F)c1F	C8H8F4N2	unknown
+NCCc1c(F)c(F)c(F)c(F)c1F	C8H6F5N	unknown
+COc1c(Cl)c(OC)c(CCN)c(OC)c1Cl	C11H15Cl2NO3	unknown
+COc1c(Br)c(OC)c(CCN)c(OC)c1Br	C11H15Br2NO3	unknown
+COc1c(Br)c(OC)c(CCN(C)C)c(OC)c1Br	C13H19Br2NO3	unknown
+CSc1c(C)c(O)c(SC)c(CC(C)N)c1O	C12H19NO2S2	unknown
+Cc1c(C)c(CC(C)N)c(C)c(C)c1CC(C)N	C16H28N2	unknown
+COc1c(F)c(F)c(CC(C)N)c(F)c1F	C10H11F4NO	unknown
+CC(N)Cc1c(F)c(F)c(F)c(F)c1F	C9H8F5N	unknown
+COc1c(OC)c2c(c(CCN)c1SC)SSS2	C11H15NO2S4	unknown
+COc1c(OC)c2c(c(CCN(C)C)c1SC)SSS2	C13H19NO2S4	unknown
+COc1c(OC)c2c(c(CCN)c1SC)SSSSS2	C11H15NO2S6	unknown
+COc1c(OC)c2c(c(CCN(C)C)c1SC)SSSSS2	C13H19NO2S6	unknown
+CNCCc1c(Br)c(Br)c(Br)c(OC)c1OC	C11H14Br3NO2	unknown
+CCCN(CCC)CCc1ccccc1O	C14H23NO	unknown
+COc1ccccc1CCNC(C)=O	C11H15NO2	unknown
+CC(N)Cc1ccccc1SCc1ccccc1	C16H19NS	unknown
+Cc1ccccc1CC(C)NN	C10H16N2	unknown
+CC(=O)NCCc1ccccc1Cl	C10H12ClNO	unknown
+CNC(C)Cc1ccccc1Br	C10H14BrN	unknown
+CNC(C)Cc1ccccc1I	C10H14IN	unknown
+CNC(C)Cc1ccccc1N	C10H16N2	unknown
+CNC(C)Cc1ccccc1[N+](=O)[O-]	C10H14N2O2	unknown
+C[Si](C)(C)c1ccccc1CCN	C11H19NSi	unknown
+CC(C)NCC(O)c1ccccc1Cl	C11H16ClNO	unknown
+CC(C)NCC(O)c1sccc1Cl	C9H14ClNOS	unknown
+CC(C)(C)NCC(O)c1sccc1Cl	C10H16ClNOS	unknown
+CC(C)NCC(O)c1sccc1Br	C9H14BrNOS	unknown
+CC(C)(C)NCC(O)c1sccc1Br	C10H16BrNOS	unknown
+CCCN(CCC)C1CC1c1ccccc1Br	C15H22BrN	unknown
+CCCN(CCC)C1CC1c1ccccc1F	C15H22FN	unknown
+CCCN(CCC)C1CC1c1ccccc1C(F)(F)F	C16H22F3N	unknown
+COc1cccc(CC(N)C(F)(F)F)c1	C10H12F3NO	unknown
+NCCc1cccc(OC(F)(F)C(F)F)c1	C10H11F4NO	unknown
+CC(N)Cc1cccc(OC(F)(F)C(F)F)c1	C11H13F4NO	unknown
+NC(Cc1cccc(O)c1)C(=O)O	C9H11NO3	unknown
+N#CC(N)Cc1cccc(O)c1	C9H10N2O	unknown
+CC(Cc1cccc(C(F)(F)F)c1)NCCCc1ccccc1	C19H22F3N	unknown
+C[Si](C)(C)c1cccc(CCN)c1	C11H19NSi	unknown
+CC(=O)NC(C)Cc1cccc(F)c1	C11H14FNO	unknown
+CC(C)(N)Cc1cccc(F)c1	C10H14FN	unknown
+CNC(C)(C)Cc1cccc(F)c1	C11H16FN	unknown
+CCC(N)(CC)Cc1cccc(F)c1	C12H18FN	unknown
+CCC(CC)(Cc1cccc(F)c1)NC	C13H20FN	unknown
+CC(Cc1cccc(Cl)c1)NN	C9H13ClN2	unknown
+CC(=O)NC(C)Cc1cccc(Cl)c1	C11H14ClNO	unknown
+CC(Cc1cccc(Br)c1)NCCCc1ccccc1	C18H22BrN	unknown
+CC(N)Cc1cccc([N+](=O)[O-])c1	C9H12N2O2	unknown
+CC(N)Cc1cccc(N)c1	C9H14N2	unknown
+FC(F)(F)c1cccc(C2CNCCO2)c1	C11H12F3NO	unknown
+CCNC(C)Cc1cccc(OC(F)(F)F)c1	C12H16F3NO	unknown
+CCNC(C)Cc1cccc(SC(F)(F)F)c1	C12H16F3NS	unknown
+CC(N)Cc1cccc(SC(F)(F)F)c1	C10H12F3NS	unknown
+CC(N)Cc1cccc(S(=O)C(F)(F)F)c1	C10H12F3NOS	unknown
+CC(N)Cc1cccc(S(=O)(=O)C(F)(F)F)c1	C10H12F3NO2S	unknown
+CCNC1(Cc2cccc(C(F)(F)F)c2)CC1	C13H16F3N	unknown
+CCNC(C)(C)Cc1cccc(C(F)(F)F)c1	C13H18F3N	unknown
+CC(Cc1cccc(C(F)(F)F)c1)NCCOC(=O)c1ccccc1	C19H20F3NO2	unknown
+CC(Cc1cccc(C(F)(F)F)c1)NCCO	C12H16F3NO	unknown
+CC(Cc1cccc(C(F)(F)F)c1)NCC(=O)O	C12H14F3NO2	unknown
+CCNCC(O)c1cccc(O)c1	C10H15NO2	unknown
+CNC(C)C(O)c1cccc(O)c1	C10H15NO2	unknown
+NCC(O)c1cccc(F)c1	C8H10FNO	unknown
+NCC(O)c1cccc(Br)c1	C8H10BrNO	unknown
+CNCC(O)c1cccc(NS(C)(=O)=O)c1	C10H16N2O3S	unknown
+C=CC(CN)c1cccc(O)c1	C10H13NO	unknown
+C#CC(CN)c1cccc(O)c1	C10H11NO	unknown
+CN(C)CCC(C)(C)c1cccc(O)c1	C13H21NO	unknown
+CC(C)(CCN)c1cccc(O)c1	C11H17NO	unknown
+COc1cccc(C2(O)CCCCC2CN(C)C)c1	C16H25NO2	unknown
+CN(C)CC1CCCCC1(O)c1cccc(O)c1	C15H23NO2	unknown
+CC[C@@H](c1cccc(O)c1)[C@@H](C)CN(C)C	C14H23NO	unknown
+COc1ccc2c(c1)C(CN)C2	C10H13NO	unknown
+Cc1cccc(OCCNC2CC2)c1	C12H17NO	unknown
+Clc1cccc(OCCNC2CC2)c1	C11H14ClNO	unknown
+Brc1cccc(OCCNC2CC2)c1	C11H14BrNO	unknown
+O=[N+]([O-])c1cccc(OCCNC2CC2)c1	C11H14N2O3	unknown
+FC(F)(F)c1cccc(OCCNC2CC2)c1	C12H14F3NO	unknown
+CC(C)NCC(O)c1cc(Cl)cs1	C9H14ClNOS	unknown
+CC(C)(C)NCC(O)c1cc(Cl)cs1	C10H16ClNOS	unknown
+CC(C)NCC(O)c1cc(Br)cs1	C9H14BrNOS	unknown
+CC(C)(C)NCC(O)c1cc(Br)cs1	C10H16BrNOS	unknown
+CC(N)Cc1ccc(Br)s1	C7H10BrNS	unknown
+CC(N)Cc1cc(Br)cs1	C7H10BrNS	unknown
+CC(N)Cc1ccc(Br)o1	C7H10BrNO	unknown
+CC(N)Cc1cccc(N(C)C)n1	C10H17N3	unknown
+CCNCCc1ccc(O)cc1	C10H15NO	unknown
+CC(N)(Cc1ccc(O)cc1)C(=O)O	C10H13NO3	unknown
+N#CC(N)Cc1ccc(O)cc1	C9H10N2O	unknown
+COc1ccc(CCNC(C)=O)cc1	C11H15NO2	unknown
+CC(Cc1ccc(O)cc1)NCCCc1ccccc1	C18H23NO	unknown
+COc1ccc(CC(C)NN)cc1	C10H16N2O	unknown
+COc1ccc(CC(N)C(F)(F)F)cc1	C10H12F3NO	unknown
+C=CCOc1ccc(CC(C)N)cc1	C12H17NO	unknown
+COc1ccc(CC(C)NCCCc2ccccc2)cc1	C19H25NO	unknown
+CCCc1ccc(CC(C)NCCCc2ccccc2)cc1	C21H29N	unknown
+CC(Cc1ccc(C(C)C)cc1)NN	C12H20N2	unknown
+CC(N)Cc1ccc(CC(C)O)cc1	C12H19NO	unknown
+NCCc1ccc(-c2ccccc2)cc1	C14H15N	unknown
+C[Si](C)(C)c1ccc(CCN)cc1	C11H19NSi	unknown
+CN(C)CCc1ccc([Si](C)(C)C)cc1	C13H23NSi	unknown
+CC(N)Cc1ccc([Si](C)(C)C)cc1	C12H21NSi	unknown
+CC[Si](CC)(CC)c1ccc(CCN)cc1	C14H25NSi	unknown
+C#CCN(C)C(C)Cc1ccc(F)cc1	C13H16FN	unknown
+CC(C)(N)Cc1ccc(F)cc1	C10H14FN	unknown
+CNC(C)(C)Cc1ccc(F)cc1	C11H16FN	unknown
+CCC(N)(CC)Cc1ccc(F)cc1	C12H18FN	unknown
+CCC(CC)(Cc1ccc(F)cc1)NC	C13H20FN	unknown
+CC(=O)NCCc1ccc(Cl)cc1	C10H12ClNO	unknown
+CC(Cc1ccc(Cl)cc1)NS(C)(=O)=O	C10H14ClNO2S	unknown
+CNC(=S)NC(C)Cc1ccc(Cl)cc1	C11H15ClN2S	unknown
+NC(CF)Cc1ccc(Cl)cc1	C9H11ClFN	unknown
+NC(Cc1ccc(Cl)cc1)C(F)(F)F	C9H9ClF3N	unknown
+CNC(C)Cc1ccc(Br)cc1	C10H14BrN	unknown
+C#CCN(C)C(C)Cc1ccc(Br)cc1	C13H16BrN	unknown
+CC(Cc1ccc(Br)cc1)NCCCc1ccccc1	C18H22BrN	unknown
+CNC(C)Cc1ccc(I)cc1	C10H14IN	unknown
+CC(Cc1ccc(I)cc1)NCCCc1ccccc1	C18H22IN	unknown
+CC(C)(N)Cc1ccc(I)cc1	C10H14IN	unknown
+CCC(N)Cc1ccc(I)cc1	C10H14IN	unknown
+CNc1ccc(CC(C)N)cc1	C10H16N2	unknown
+CC(N)Cc1ccc(N(C)C)cc1	C11H18N2	unknown
+CNC1CCc2cc(OC)ccc2C1	C12H17NO	unknown
+COc1ccc2c(c1)CCC2CN	C11H15NO	unknown
+COc1ccc2c(c1)CCCC2CN	C12H17NO	unknown
+CC(Cc1ccc(Cl)cc1)N(C)C	C11H16ClN	unknown
+CC(N)C(O)c1ccc(Cl)cc1	C9H12ClNO	unknown
+NC1CC1c1ccc(O)cc1	C9H11NO	unknown
+COc1cc(CCNCc2cc(Br)ccc2O)c(OC)cc1Br	C17H19Br2NO3	unknown
+CN(C)c1ccc(C2CC2N)cc1	C11H16N2	unknown
+NC1CC1c1ccc(Cl)cc1	C9H10ClN	unknown
+COc1ccc(C2CCC2N)cc1	C11H15NO	unknown
+Cc1ccc(OCCNC2CC2)cc1	C12H17NO	unknown
+COc1ccc(OCCNC2CC2)cc1	C12H17NO2	unknown
+Nc1ccc(OCCNC2CC2)cc1	C11H16N2O	unknown
+Brc1ccc(OCCNC2CC2)cc1	C11H14BrNO	unknown
+CC(N)Cc1ccc(S(=O)(=O)N(C)C)cc1	C11H18N2O2S	unknown
+CC(N)Cc1ccc(NS(C)(=O)=O)cc1	C10H16N2O2S	unknown
+CC(N)Cc1ccc(S(N)(=O)=O)cc1	C9H14N2O2S	unknown
+CC(N)Cc1ccc(NC(=O)c2ccccc2)cc1	C16H18N2O	unknown
+CC(N)C(F)c1ccc(F)cc1	C9H11F2N	unknown
+CC(N)C(F)c1ccc(Cl)cc1	C9H11ClFN	unknown
+CC(N)C(F)c1ccc(Br)cc1	C9H11BrFN	unknown
+CC(N)C(F)(F)c1ccc(F)cc1	C9H10F3N	unknown
+CC(N)C(F)(F)c1ccc(Br)cc1	C9H10BrF2N	unknown
+CCNC1(Cc2ccc(Cl)cc2)CC1	C12H16ClN	unknown
+CC(=O)NC(Cc1ccc(Br)cc1)c1cccs1	C14H14BrNOS	unknown
+CCN(CC)CCOc1ccc([N+](=O)[O-])cc1	C12H18N2O3	unknown
+CCN(CC)CCCc1ccc([N+](=O)[O-])cc1	C13H20N2O2	unknown
+CCN(CC)CCOc1ccc(C#N)cc1	C13H18N2O	unknown
+CCN(CC)CCCc1ccc(C#N)cc1	C14H20N2	unknown
+CCN(CC)C(C)COc1ccc(C#N)cc1	C14H20N2O	unknown
+CC(C)NCC(O)c1ccc(NS(C)(=O)=O)cc1	C12H20N2O3S	unknown
+CC(NCCc1ccc(O)cc1)C(O)c1ccc(O)cc1	C17H21NO3	unknown
+CC(COc1ccccc1)NC(C)C(O)c1ccc(O)cc1	C18H23NO3	unknown
+CC(C)NCC(O)c1ccc([N+](=O)[O-])cc1	C11H16N2O3	unknown
+CC(C)N(C)CC(O)c1ccc([N+](=O)[O-])cc1	C12H18N2O3	unknown
+COC(CNC(C)C)c1ccc([N+](=O)[O-])cc1	C12H18N2O3	unknown
+CC(C)N1CCOC(c2ccc([N+](=O)[O-])cc2)C1	C13H18N2O3	unknown
+COc1ccc(C(CN(C)C)C2(O)CCCCC2)cc1	C17H27NO2	unknown
+CN(C)CC(c1ccc(O)cc1)C1(O)CCCCC1	C16H25NO2	unknown
+c1ccc(OCc2ccc(CCCN3CCOCC3)cc2)cc1	C20H25NO2	unknown
+NC(Cc1ccccc1)C(=O)O	C9H11NO2	unknown
+NC(Cc1ccccc1O)C(=O)O	C9H11NO3	unknown
+O=C(NC(CO)C(O)c1ccc([N+](=O)[O-])cc1)C(Cl)Cl	C11H12Cl2N2O5	unknown
+NC(CSc1c(CC(N)C(=O)O)ccc(O)c1O)C(=O)O	C12H16N2O6S	unknown
+NC(CSc1cc(CC(N)C(=O)O)cc(O)c1O)C(=O)O	C12H16N2O6S	unknown
+NC(Cc1cc(O)c(O)cc1O)C(=O)O	C9H11NO5	unknown
+COc1ccc(C23CCC(=O)CC2N(C)CC3)cc1OC	C17H23NO3	unknown
+CNCCC1(c2ccc(O)cc2)C=CC(=O)CC1	C15H19NO2	unknown
+NC(Cc1cc(I)c(Oc2cc(I)c(O)c(I)c2)c(I)c1)C(=O)O	C15H11I4NO4	unknown
+NC(Cc1cc(I)c(Oc2ccc(O)c(I)c2)c(I)c1)C(=O)O	C15H12I3NO4	unknown
+NCCc1ccc(Oc2ccc(O)cc2)cc1	C14H15NO2	unknown
+NCCc1ccc(Oc2ccc(O)cc2)c(I)c1	C14H14INO2	unknown
+NCCc1ccccc1CCc1ccccc1	C16H19N	unknown
+COc1cc(CCN(C)CCCNC(C)=O)c(Br)cc1Br	C15H22Br2N2O2	unknown
+CN(C)CCCOc1c(I)cc(CCN(C)C)cc1I	C15H24I2N2O	unknown
+CC(Cc1ccccc1)NCCCc1ccccc1	C18H23N	unknown
+CC(Cc1ccccc1)NCCCCCc1ccccc1	C20H27N	unknown
+NNCCc1ccccc1	C8H12N2	unknown
+CC(Cc1ccccc1)NN	C9H14N2	unknown
+C[C@@H](Cc1ccccc1)NC(=O)[C@@H](N)CCCCN	C15H25N3O	unknown
+N#CC(N)Cc1ccccc1	C9H10N2	unknown
+C#CC(N)Cc1ccccc1	C10H11N	unknown
+CC(N)C(C)c1ccccc1	C10H15N	unknown
+CNC(C)C(C)c1ccccc1	C11H17N	unknown
+CN(C)CC1(c2ccccc2)CCC1	C13H19N	unknown
+CNCCC(Oc1ccc(C(F)(F)F)cc1)c1ccccc1	C17H18F3NO	unknown
+c1ccc(CC2CN2)cc1	C9H11N	unknown
+OC1CCCNC1C(c1ccccc1)c1ccccc1	C18H21NO	unknown
+OC(c1ccccc1)(c1ccccc1)C1CCCNC1	C18H21NO	unknown
+CC1Cc2ccccc2CN1	C10H13N	unknown
+CC(C)NC(C)Cc1ccccc1	C12H19N	unknown
+CC(Cc1ccccc1)NC(C)(C)C	C13H21N	unknown
+CCCCCCNC(C)Cc1ccccc1	C15H25N	unknown
+CC(Cc1ccccc1)NCc1ccccc1	C16H19N	unknown
+CC(Cc1ccccc1)NCCc1ccccc1	C17H21N	unknown
+CC(Cc1ccccc1)NCCC(c1ccccc1)c1ccccc1	C24H27N	unknown
+CC(Cc1ccccc1)NC1CC1	C12H17N	unknown
+CC(Cc1ccccc1)NC1CCC1	C13H19N	unknown
+CC(Cc1ccccc1)NC1CCCC1	C14H21N	unknown
+CC(Cc1ccccc1)NC1CCCCC1	C15H23N	unknown
+CC(Cc1ccccc1)NC1CCCCCC1	C16H25N	unknown
+CC(C)CNC(C)Cc1ccccc1	C13H21N	unknown
+COCCNC(C)Cc1ccccc1	C12H19NO	unknown
+CC(Cc1ccccc1)NCCCO	C12H19NO	unknown
+CC(Cc1ccccc1)NCCBr	C11H16BrN	unknown
+CC(Cc1ccccc1)NCCCBr	C12H18BrN	unknown
+CC(Cc1ccccc1)Nc1ccccc1	C15H17N	unknown
+COc1cc(CC(N)OC)c(OC)cc1C	C12H19NO3	unknown
+CC(Cc1ccccc1)NCCCCCF	C14H22FN	unknown
+CC(Cc1ccccc1)NCC12CC3CC(CC(C3)C1)C2	C20H29N	unknown
+CC(Cc1ccccc1)NCC1CC1	C13H19N	unknown
+CC(Cc1ccccc1)NCCCCc1ccccc1	C19H25N	unknown
+CC(Cc1ccccc1)NCCOc1ccccc1	C17H21NO	unknown
+CC(Cc1ccccc1)NCC#Cc1ccccc1	C18H19N	unknown
+CC(Cc1ccccc1)NCCC(=O)c1ccccc1	C18H21NO	unknown
+CC(Cc1ccccc1)NCCCc1cccc2ccccc12	C22H25N	unknown
+CC(Cc1ccccc1)NCCCc1ccc2ccccc2c1	C22H25N	unknown
+CCCCCCNCCc1ccccc1	C14H23N	unknown
+c1ccc(CCNCc2ccccc2)cc1	C15H17N	unknown
+c1ccc(CCNCCc2ccccc2)cc1	C16H19N	unknown
+c1ccc(CCCNCCc2ccccc2)cc1	C17H21N	unknown
+c1ccc(CCNCCCc2ccc3ccccc3c2)cc1	C21H23N	unknown
+C(=C/c1cccnc1)\CCCNCCc1ccccc1	C18H22N2	unknown
+CC(Cc1ccccc1)/N=C/C(Cl)(Cl)Cl	C11H12Cl3N	unknown
+CC(Cc1ccccc1)NC(C#N)c1ccccc1	C17H18N2	unknown
+CC(COc1ccccc1)NC(C)Cc1ccccc1	C18H23NO	unknown
+CCC(O)c1ccc(OCCNC(C)Cc2ccccc2)cc1	C20H27NO2	unknown
+CC(Cc1ccccc1)NCCCCl	C12H18ClN	unknown
+CCN(C)C(C)Cc1ccccc1	C12H19N	unknown
+CC(C)N(C)C(C)Cc1ccccc1	C13H21N	unknown
+CCCN(CCC)C(C)Cc1ccccc1	C15H25N	unknown
+CCCCN(CCCC)C(C)Cc1ccccc1	C17H29N	unknown
+CCCN(C)C(C)Cc1ccccc1	C13H21N	unknown
+CCCCN(C)C(C)Cc1ccccc1	C14H23N	unknown
+CC(Cc1ccccc1)N(C)CCc1ccccc1	C18H23N	unknown
+CC(Cc1ccccc1)N(C)CCCCCc1ccccc1	C21H29N	unknown
+CC(Cc1ccccc1)N(C)CCCc1ccc2ccccc2c1	C23H27N	unknown
+CC(Cc1ccccc1)N(C)CCCc1ccccc1	C19H25N	unknown
+CC(Cc1ccccc1)N(CCCc1ccccc1)Cc1ccccc1	C25H29N	unknown
+CN(CCCCCc1ccccc1)CCc1ccccc1	C20H27N	unknown
+CC(Cc1ccccc1)N(C)CC#N	C12H16N2	unknown
+CC(Cc1ccccc1)N(C(C)Cc1ccccc1)C(C)Cc1ccccc1	C27H33N	unknown
+CCC(=O)N(c1ccccc1)C1CCN(C(C)Cc2ccccc2)CC1	C23H30N2O	fentanyl
+CN(CCCc1ccccc1)CCCc1ccccc1	C19H25N	unknown
+CN(CCCCCc1ccccc1)CCCc1ccccc1	C21H29N	unknown
+CCC(=O)N(c1ccccc1)C1CCN(CCc2ccccc2)CC1	C22H28N2O	fentanyl
+CCC(=O)N(c1ccccc1)C1(COC)CCN(CCc2cccs2)CC1	C22H30N2O2S	fentanyl
+CCC(=O)N(c1ccccc1)C1(C(=O)OC)CCN(CCc2ccccc2)CC1	C24H30N2O3	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CC(O)c2ccc(F)cc2)CC1C	C23H29FN2O2	fentanyl
+CNNC(C)Cc1ccccc1	C10H16N2	unknown
+CC(Cc1ccccc1)NN(C)C	C11H18N2	unknown
+CC(CNN)c1ccccc1	C9H14N2	unknown
+NNCC(O)c1ccccc1	C8H12N2O	unknown
+CC(CCc1ccccc1)NN	C10H16N2	unknown
+CC(Cc1ccccc1)[N+](C)([O-])Cc1ccccc1	C17H21NO	unknown
+CC(Cc1ccccc1)NS(C)(=O)=O	C10H15NO2S	unknown
+CC(Cc1ccccc1)NS(=O)(=O)C(F)(F)F	C10H12F3NO2S	unknown
+CC(Cc1ccccc1)NC(=S)S	C10H13NS2	unknown
+CNC(=S)NC(C)Cc1ccccc1	C11H16N2S	unknown
+N=C(N)NCCc1ccccc1	C9H13N3	unknown
+N=C(N)NCC(O)c1ccccc1	C9H13N3O	unknown
+C=C(C)C(=O)NCCc1ccccc1	C12H15NO	unknown
+CC(Cc1ccccc1)NC=O	C10H13NO	unknown
+CC(=O)NC(C)Cc1ccccc1	C11H15NO	unknown
+N#CNCCc1ccccc1	C9H10N2	unknown
+CN(C#N)CCc1ccccc1	C10H12N2	unknown
+CC(Cc1ccccc1)NC#N	C10H12N2	unknown
+CC(N)[Si](C)(C)c1ccccc1	C10H17NSi	unknown
+CC(N)C(C)(C)c1ccccc1	C11H17N	unknown
+CN(C)CCOc1ccccc1Cc1ccccc1	C17H21NO	unknown
+c1ccc(OCCNC2CC2)cc1	C11H15NO	unknown
+c1ccc(SCCNC2CC2)cc1	C11H15NS	unknown
+NC1CC1Oc1ccccc1	C9H11NO	unknown
+CC1C(N)C1Oc1ccccc1	C10H13NO	unknown
+CNC[C@H](O)c1ccccc1	C9H13NO	unknown
+CC(C)(C)NCC(O)c1cc(O)cc(O)c1	C12H19NO3	unknown
+CC(C)NCC(O)c1ccc(Cl)c(Cl)c1	C11H15Cl2NO	unknown
+NCC(S)c1ccccc1	C8H11NS	unknown
+CNC(C)C(S)c1ccccc1	C10H15NS	unknown
+CC(C(S)c1ccccc1)N(C)C	C11H17NS	unknown
+CNC(C)C(NC)c1ccccc1	C11H18N2	unknown
+NC(C(O)c1ccccc1)C(F)(F)F	C9H10F3NO	unknown
+CNC(C)C(Br)c1ccccc1	C10H14BrN	unknown
+CNC(C)C(Cl)c1ccccc1	C10H14ClN	unknown
+CNC(C)C(I)c1ccccc1	C10H14IN	unknown
+CN(C)CC(Cl)c1ccccc1	C10H14ClN	unknown
+CN(C)CC(Br)c1ccccc1	C10H14BrN	unknown
+CCCC(N)Cc1ccccc1	C11H17N	unknown
+CCCCC(N)Cc1ccccc1	C12H19N	unknown
+NC(Cc1ccccc1)Cc1ccccc1	C15H17N	unknown
+NC(Cc1ccccc1)CC1CC1	C12H17N	unknown
+NC(Cc1ccccc1)CC1CCC1	C13H19N	unknown
+CCCC(Cc1ccccc1)NC(C)C	C14H23N	unknown
+CCCC(Cc1ccccc1)NCCCO	C14H23NO	unknown
+CCCNC(Cc1ccccc1)c1ccccc1	C17H21N	unknown
+CCCNC(CCC)Cc1ccccc1	C14H23N	unknown
+CCC(Cc1ccccc1)NCCc1ccccc1	C18H23N	unknown
+CCCNC(Cc1ccccc1)Cc1ccccc1	C18H23N	unknown
+CCCNC(CC)Cc1ccccc1	C13H21N	unknown
+CCCC(Cc1ccccc1)NC	C12H19N	unknown
+CCCCC(Cc1ccccc1)NCCC	C15H25N	unknown
+CCCCC(Cc1ccccc1)NC(C)Cc1ccccc1	C21H29N	unknown
+CCCCCCC(Cc1ccccc1)NCCC	C17H29N	unknown
+CCNC(Cc1ccccc1)C1CCCO1	C14H21NO	unknown
+CCNC(Cc1ccccc1)c1ccco1	C14H17NO	unknown
+CCC(C)(N)Cc1ccccc1	C11H17N	unknown
+CCC(CN)c1ccccc1	C10H15N	unknown
+CCC(CNC)c1ccccc1	C11H17N	unknown
+CCC(CN(C)C)c1ccccc1	C12H19N	unknown
+CCNCC(CC)c1ccccc1	C12H19N	unknown
+CCC(CN(CC)CC)c1ccccc1	C14H23N	unknown
+CNCC(c1ccccc1)C1CCCCC1	C15H23N	unknown
+C=C(CN)c1ccccc1	C9H11N	unknown
+C=CC(CN)c1ccccc1	C10H13N	unknown
+C#CC(CN)c1ccccc1	C10H11N	unknown
+CCC(c1ccccc1)C(C)N	C11H17N	unknown
+CCCC(c1ccccc1)C(C)N	C12H19N	unknown
+CC(C)C(c1ccccc1)C(C)N	C12H19N	unknown
+CC(N)C(c1ccccc1)c1ccccc1	C15H17N	unknown
+CN(C)CC1(c2ccccc2)CCC1=O	C13H17NO	unknown
+CC(C)CC(N(C)C)C1(c2ccccc2)CCC1	C17H27N	unknown
+NC/C(=C\F)c1ccccc1	C9H10FN	unknown
+NCC(=C(F)F)c1ccccc1	C9H9F2N	unknown
+NC/C(=C\Cl)c1ccccc1	C9H10ClN	unknown
+NC/C(=C/Cl)c1ccccc1	C9H10ClN	unknown
+NC/C(=C/Br)c1ccccc1	C9H10BrN	unknown
+NCC(=C(Br)Br)c1ccccc1	C9H9Br2N	unknown
+NC/C(=C/F)c1ccccc1	C9H10FN	unknown
+NC/C(=C/F)c1ccc(O)cc1	C9H10FNO	unknown
+COc1ccc(/C(=C\F)CN)cc1	C10H12FNO	unknown
+NCCC(Oc1ccc(C(F)(F)F)cc1)c1ccccc1	C16H16F3NO	unknown
+CNCC[C@H](Oc1cccc2ccccc12)c1cccs1	C18H19NOS	unknown
+NC1C2CCCC12c1ccccc1	C12H15N	unknown
+NC12CCCC1C2c1ccccc1	C12H15N	unknown
+NC1C2Cc3ccccc3C12	C10H11N	unknown
+NC1(c2ccccc2)CC1	C9H11N	unknown
+NCC1CC1c1ccccc1	C10H13N	unknown
+NC1CC1Cc1ccccc1	C10H13N	unknown
+NC1C(F)C1c1ccccc1	C9H10FN	unknown
+NC1CC1(F)c1ccccc1	C9H10FN	unknown
+NCC1C(F)C1c1ccccc1	C10H12FN	unknown
+CCCN(CCC)C1CC1c1ccccc1	C15H23N	unknown
+CCN(CC)C(=O)C1(c2ccccc2)CC1CN	C15H22N2O	unknown
+NCC1(O)CCC1c1ccccc1	C11H15NO	unknown
+NC1CCC1(O)c1ccccc1	C10H13NO	unknown
+NC1CCCC1c1ccccc1	C11H15N	unknown
+NC1CCCCC1c1ccccc1	C12H17N	unknown
+CC(C)NC1CCCCC1c1ccccc1	C15H23N	unknown
+CCOC(=O)[C@@]1(c2ccccc2)CCC=C[C@@H]1N(C)C	C17H23NO2	unknown
+c1ccc(C2CN2)cc1	C8H9N	unknown
+CC1NC1c1ccccc1	C9H11N	unknown
+CCC1NC1c1ccccc1	C10H13N	unknown
+CC1(C)NC1c1ccccc1	C10H13N	unknown
+c1ccc(CCN2CC2)cc1	C10H13N	unknown
+OC1(c2ccccc2)CNC1	C9H11NO	unknown
+CC1NCC1(O)c1ccccc1	C10H13NO	unknown
+CN(C)C1=NC(=O)C(C)(c2ccccc2)O1	C12H14N2O2	unknown
+C#CCNC1=NC(=O)C(c2ccccc2)O1	C12H10N2O2	unknown
+Nc1ncc(-c2ccccc2)o1	C9H8N2O	unknown
+CCC1N=C(N)OC1c1ccccc1	C11H14N2O	unknown
+CC(C)C1N=C(N)OC1c1ccccc1	C12H16N2O	unknown
+CNC1=NC(C)C(c2ccccc2)O1	C11H14N2O	unknown
+CCNC1=NC(C)C(c2ccccc2)O1	C12H16N2O	unknown
+CC1N=C(N(C)C)OC1c1ccccc1	C12H16N2O	unknown
+CC1C(c2ccccc2)OC(=N)N1C	C11H14N2O	unknown
+Nc1nc(O)c(-c2ccccc2)s1	C9H8N2OS	unknown
+NC(=O)CN1CC(c2ccccc2)CC1=O	C12H14N2O2	unknown
+c1ccc(CC2=NCCN2)cc1	C10H12N2	unknown
+c1ccc(CN2CCCCC2)cc1	C12H17N	unknown
+c1ccc(CC2CCCCN2)cc1	C12H17N	unknown
+COC(=O)C(c1cccc2ccccc12)C1CCCCN1	C18H21NO2	unknown
+COC(=O)C(c1ccc2ccccc2c1)C1CCCCN1	C18H21NO2	unknown
+CC(=O)OC(c1ccccc1)C1CCCCN1	C14H19NO2	unknown
+CCc1cccc(CC)c1NC(=O)CNCC(C)c1ccccc1	C21H28N2O	unknown
+c1ccc(C2CCCNC2)cc1	C11H15N	unknown
+c1ccc(CCN2CCNCC2)cc1	C12H18N2	unknown
+CC1CNC(C)C(c2ccccc2)O1	C12H17NO	unknown
+CC1(C)COC(c2ccccc2)CN1	C12H17NO	unknown
+CC1NCCCC1c1ccccc1	C12H17N	unknown
+c1ccc(CC2COCCN2)cc1	C11H15NO	unknown
+CC1C(c2ccccc2)SCCN1C	C12H17NS	unknown
+COc1cc(CCO)cc(OC)c1OC	C11H16O4	unknown
+NCC1Cc2ccccc21	C9H11N	unknown
+C#CCN(C)C1Cc2ccccc2C1	C13H15N	unknown
+c1ccc(CCCNC2Cc3ccccc3C2)cc1	C18H21N	unknown
+c1ccc(CCCNC2CCCc3ccccc3C2)cc1	C20H25N	unknown
+C#CCNC1Cc2ccccc2C1	C12H13N	unknown
+COc1ccc(OC)c(CCNCc2cc(Br)ccc2OC)c1	C18H22BrNO3	unknown
+CC1Cc2ccccc2CN1C	C11H15N	unknown
+CC1CNCc2ccccc21	C10H13N	unknown
+NCC1CCCc2ccccc21	C11H15N	unknown
+NCCc1ccccc1Cc1ccccc1	C15H17N	unknown
+CC1(CN)c2ccccc2Cc2ccccc21	C16H17N	unknown
+CC1(C)c2ccccc2C(CN)c2ccccc21	C17H19N	unknown
+CC(N)C1c2ccccc2Cc2ccccc21	C16H17N	unknown
+c1ccc2c(c1)Cc1cccc3c1C2CNC3	C16H15N	unknown
+CNCC1c2ccccc2Cc2ccccc21	C16H17N	unknown
+CN(C)CC1c2ccccc2Cc2ccccc21	C17H19N	unknown
+CNCC(c1ccccc1)c1ccccc1	C15H17N	unknown
+CN(C)CC(c1ccccc1)c1ccccc1	C16H19N	unknown
+NCCC(c1ccccc1)c1ccccc1	C15H17N	unknown
+CNCCC(c1ccccc1)c1ccccc1	C16H19N	unknown
+CN(C)CCC(c1ccccc1)c1ccccc1	C17H21N	unknown
+NCC1c2ccccc2Cc2cc(CCCc3ccccc3)ccc21	C24H25N	unknown
+CCCCCCc1ccc2c(c1)Cc1ccccc1C2CN	C21H27N	unknown
+COc1ccc2c(c1)Cc1ccccc1C2CN	C16H17NO	unknown
+CCCCCOc1ccc2c(c1)Cc1ccccc1C2CN	C20H25NO	unknown
+NCC1c2ccccc2Cc2cc(O)ccc21	C15H15NO	unknown
+CCCCCCc1ccc2c(c1)Cc1cc(OC)ccc1C2CN	C22H29NO	unknown
+c1ccc(C2CCNC2)cc1	C10H13N	unknown
+c1ccc2c(c1)CCN1CCc3ccccc3C21	C17H17N	unknown
+CN(C)C1Cc2ccccc2Oc2ccccc21	C16H17NO	unknown
+CN(C)C1Cc2ccccc2Cc2ccccc21	C17H19N	unknown
+NCCc1cccs1	C6H9NS	unknown
+NCCc1ccsc1	C6H9NS	unknown
+CC(N)Cc1cccs1	C7H11NS	unknown
+CC(N)Cc1ccsc1	C7H11NS	unknown
+CC(N)Cc1ccco1	C7H11NO	unknown
+CC(N)Cc1ccc[se]1	C7H11NSe	unknown
+NCCc1c[nH]cn1	C5H9N3	unknown
+NCCc1cscn1	C5H8N2S	unknown
+NCCc1ccccn1	C7H10N2	unknown
+CC(N)Cc1ccccn1	C8H12N2	unknown
+NCCc1cccnc1	C7H10N2	unknown
+CC(N)Cc1cccnc1	C8H12N2	unknown
+NCCc1ccncc1	C7H10N2	unknown
+NCCn1cccc1	C6H10N2	unknown
+CNCCn1cccc1	C7H12N2	unknown
+CN(C)CCn1cccc1	C8H14N2	unknown
+CCN(CC)CCn1cccc1	C10H18N2	unknown
+CC(CN)n1cccc1	C7H12N2	unknown
+CNCC(C)n1cccc1	C8H14N2	unknown
+CC(CN(C)C)n1cccc1	C9H16N2	unknown
+NCCc1ccc[nH]1	C6H10N2	unknown
+CNCCc1ccc[nH]1	C7H12N2	unknown
+CN(C)CCc1ccc[nH]1	C8H14N2	unknown
+CCNCCc1ccc[nH]1	C8H14N2	unknown
+CCN(CC)CCc1ccc[nH]1	C10H18N2	unknown
+CC(N)Cc1ccc[nH]1	C7H12N2	unknown
+CCCN(CCC)CCc1cc[nH]c1	C12H22N2	unknown
+CNCC(O)c1cc[nH]c1	C7H12N2O	unknown
+CC(C)NCC(O)c1cc[nH]c1	C9H16N2O	unknown
+CC(N)C(O)c1cc[nH]c1	C7H12N2O	unknown
+CC(C(O)c1cc[nH]c1)N(C)C	C9H16N2O	unknown
+CC(C)NC(C)C(O)c1cc[nH]c1	C10H18N2O	unknown
+CNC(C)C(O)c1ccco1	C8H13NO2	unknown
+CCC(N)Cc1ccco1	C8H13NO	unknown
+CCCC(N)Cc1ccco1	C9H15NO	unknown
+CNCCc1ccco1	C7H11NO	unknown
+CNC(C)Cc1ccco1	C8H13NO	unknown
+C=C(CN)c1ccco1	C7H9NO	unknown
+C=C(CN)c1cccs1	C7H9NS	unknown
+NCCc1ccoc1	C6H9NO	unknown
+C=C(CN)c1ccoc1	C7H9NO	unknown
+C=C(CN)c1ccsc1	C7H9NS	unknown
+CNCCc1cccs1	C7H11NS	unknown
+CC(N)C(C)c1cccs1	C8H13NS	unknown
+CC(CN)c1cccs1	C7H11NS	unknown
+CCC(N)C(C)c1cccs1	C9H15NS	unknown
+CCCC(N)C(C)c1cccs1	C10H17NS	unknown
+CC(c1cccs1)C(N)Cc1ccccc1	C14H17NS	unknown
+CC(O)(CN)c1cccs1	C7H11NOS	unknown
+CCC(O)(CN)c1cccs1	C8H13NOS	unknown
+CCCC(O)(CN)c1cccs1	C9H15NOS	unknown
+CC(N)C(C)(O)c1cccs1	C8H13NOS	unknown
+CCC(N)C(C)(O)c1cccs1	C9H15NOS	unknown
+NC1CCCC1c1cccs1	C9H13NS	unknown
+NC1CCCC1(O)c1cccs1	C9H13NOS	unknown
+CCC(N)Cc1cccs1	C8H13NS	unknown
+C=CCC(N)Cc1cccs1	C9H13NS	unknown
+C=C(CNC)c1cccs1	C8H11NS	unknown
+C=C(c1cccs1)C(C)N	C8H11NS	unknown
+NC1CC1c1cccs1	C7H9NS	unknown
+CCCN(CCC)C1CC1c1cccs1	C13H21NS	unknown
+CNCCc1ccsc1	C7H11NS	unknown
+NC1CC1c1ccsc1	C7H9NS	unknown
+CCCN(CCC)C1CC1c1ccsc1	C13H21NS	unknown
+NC(Cc1c[nH]cn1)C(=O)O	C6H9N3O2	unknown
+Cn1cnc(CCN)c1	C6H11N3	unknown
+Cn1cncc1CCN	C6H11N3	unknown
+NCCn1ccnc1	C5H9N3	unknown
+NCCc1ncc[nH]1	C5H9N3	unknown
+CC(N)Cc1ncc[nH]1	C6H11N3	unknown
+CC(CN)c1ncc[nH]1	C6H11N3	unknown
+Cc1[nH]cnc1CCN	C6H11N3	unknown
+CC(N)Cc1c[nH]cn1	C6H11N3	unknown
+NC1CC1c1c[nH]cn1	C6H9N3	unknown
+NCC(O)c1c[nH]cn1	C5H9N3O	unknown
+CNCC(O)c1c[nH]cn1	C6H11N3O	unknown
+CN(C)CC(O)c1c[nH]cn1	C7H13N3O	unknown
+CC(C)NCC(O)c1c[nH]cn1	C8H15N3O	unknown
+CC(N)C(O)c1c[nH]cn1	C6H11N3O	unknown
+NCCc1ncco1	C5H8N2O	unknown
+NCCc1cocn1	C5H8N2O	unknown
+NCCc1cnco1	C5H8N2O	unknown
+COc1ccc2occ(CCN(C(C)C)C(C)C)c2c1	C17H25NO2	unknown
+NCCc1nccs1	C5H8N2S	unknown
+NC(Cc1nccs1)C(=O)O	C6H8N2O2S	unknown
+NC(Cc1cscn1)C(=O)O	C6H8N2O2S	unknown
+CC(N)Cc1cscn1	C6H10N2S	unknown
+CC(N)Cc1cncs1	C6H10N2S	unknown
+CC(CN)c1nccs1	C6H10N2S	unknown
+CNCC(C)c1nccs1	C7H12N2S	unknown
+CC(N)Cc1nccs1	C6H10N2S	unknown
+CNC(C)Cc1nccs1	C7H12N2S	unknown
+NCCc1ccon1	C5H8N2O	unknown
+NCCc1cnoc1	C5H8N2O	unknown
+NCCc1ccno1	C5H8N2O	unknown
+NCCc1ccns1	C5H8N2S	unknown
+CC(N)Cc1ccns1	C6H10N2S	unknown
+CNCCc1ccccn1	C8H12N2	unknown
+CNC(C)Cc1ccccn1	C9H14N2	unknown
+CCN(CC)CCc1ccccn1	C11H18N2	unknown
+CCCCC(c1ccccn1)C(C)N	C12H20N2	unknown
+CC(N)Cc1ccncc1	C8H12N2	unknown
+NCCc1cccnn1	C6H9N3	unknown
+NCCc1ncccn1	C6H9N3	unknown
+CCC(=O)n1cc2c3c(cccc31)C1=C[C@@H](C(=O)N(CC)CC)CN(CC)[C@@H]1C2	C24H31N3O2	unknown
+COc1ccc(OC)c(CCNCc2cc(Br)ccc2O)c1	C17H20BrNO3	unknown
+Oc1ccc(Br)cc1CNCCc1c[nH]c2ccccc12	C17H17BrN2O	tryptamine
+COc1ccccc1CNCC(C)c1ccccc1	C17H21NO	unknown
+COc1ccc(OC)c(NC(=O)CNCC(C)c2ccccc2)c1	C19H24N2O3	unknown
+C=CCN(CC=C)CCc1c(-c2ccccc2)[nH]c2ccccc12	C22H24N2	tryptamine
+C=CCN(CC=C)CCc1c[nH]c2ccc3c(c12)OCCO3	C18H22N2O2	tryptamine
+C=CCN(CC=C)CCc1c[nH]c2ccc(C)cc12	C17H22N2	tryptamine
+C=CCN(CC=C)CCc1c[nH]c2ccc(F)cc12	C16H19FN2	tryptamine
+C=CCN(CC=C)CCc1c(C)[nH]c2ccc(F)cc12	C17H21FN2	tryptamine
+C=CCN(CC=C)CCc1c[nH]c2ccc(Cl)cc12	C16H19ClN2	tryptamine
+C=CCN(CC=C)CCc1c[nH]c2ccc(Br)cc12	C16H19BrN2	tryptamine
+C=CCN(CC=C)CCc1c[nH]c2cc3c(cc12)OCO3	C17H20N2O2	tryptamine
+C=CCN(CC=C)CCc1c[nH]c2cc(F)ccc12	C16H19FN2	tryptamine
+C=CCN(CC=C)CCc1c[nH]c2c(C)cccc12	C17H22N2	tryptamine
+C=CCN(CC=C)CCc1c[nH]c2c(CC)cccc12	C18H24N2	tryptamine
+C[C@@H]1[C@H](C)N1C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C20H23N3O	unknown
+C[C@H]1[C@H](C)N1C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C20H23N3O	unknown
+C[C@@H]1[C@@H](C)N1C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C20H23N3O	unknown
+CN1C[C@H](C(=O)NC2CC2)C=C2c3cccc4[nH]cc(c34)C[C@H]21	C19H21N3O	unknown
+CN1C[C@H](C(=O)NC2CCC2)C=C2c3cccc4[nH]cc(c34)C[C@H]21	C20H23N3O	unknown
+CN1C[C@H](C(=O)NC2CCCC2)C=C2c3cccc4[nH]cc(c34)C[C@H]21	C21H25N3O	unknown
+CN1C[C@H](C(=O)NC2CCCCC2)C=C2c3cccc4[nH]cc(c34)C[C@H]21	C22H27N3O	unknown
+CN1C[C@H](C(=O)NC2CCCCCC2)C=C2c3cccc4[nH]cc(c34)C[C@H]21	C23H29N3O	unknown
+CC[C@@H](C)NC(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C20H25N3O	unknown
+CC[C@H](C)NC(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C20H25N3O	unknown
+C[C@H](Cl)[C@@H](C)NC(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C20H24ClN3O	unknown
+C[C@H](Cl)[C@H](C)NC(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C20H24ClN3O	unknown
+C[C@@H](Cl)[C@@H](C)NC(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C20H24ClN3O	unknown
+C[C@H](NC(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1)[C@@H](C)Cl	C20H24ClN3O	unknown
+COc1ccccc1CNC(C)Cc1ccc(OC)c(OC)c1	C19H25NO3	unknown
+CCc1ccc(CC(C)NCc2ccccc2OC)cc1	C19H25NO	unknown
+COc1ccccc1CNC(C)Cc1ccc(C)cc1	C18H23NO	unknown
+COc1ccccc1CNC(C)Cc1ccc2occc2c1	C19H21NO2	unknown
+CCN(CC)CCn1ncc2ccc(OC)cc21	C14H21N3O	unknown
+CCCN(CCC)CCn1ncc2ccc(OC)cc21	C16H25N3O	unknown
+CCN(C)CCn1ncc2ccc(OC)cc21	C13H19N3O	unknown
+COc1ccc2cnn(CCN(C)C(C)C)c2c1	C14H21N3O	unknown
+COc1cc(Br)c(O)cc1CCNCc1ccccc1OC	C17H20BrNO3	unknown
+COc1cc(Br)ccc1CCNCc1ccccc1OC	C17H20BrNO2	unknown
+COc1cc(Br)c(F)cc1CCNCc1ccccc1OC	C17H19BrFNO2	unknown
+COc1cc(Br)c(Cl)cc1CCNCc1ccccc1OC	C17H19BrClNO2	unknown
+COc1cc(Br)c(C(F)(F)F)cc1CCNCc1ccccc1OC	C18H19BrF3NO2	unknown
+COc1cc(Br)c(I)cc1CCNCc1ccccc1OC	C17H19BrINO2	unknown
+COc1cc(Br)c(OC(C)C)cc1CCNCc1ccccc1OC	C20H26BrNO3	unknown
+COCCOc1cc(CCNCc2ccccc2OC)c(OC)cc1Br	C20H26BrNO4	unknown
+COc1cc(C2CCOC2)c(OC)cc1CCN	C14H21NO3	unknown
+COc1cc(C2CCCO2)c(OC)cc1CCN	C14H21NO3	unknown
+COc1cc(Br)c(O)cc1CCN	C9H12BrNO2	unknown
+COCc1cc(OC)c(CCN)cc1OC	C12H19NO3	prophetic
+COc1cc(Br)c(F)cc1CCN	C9H11BrFNO	unknown
+COc1cc(Br)c(Cl)cc1CCN	C9H11BrClNO	unknown
+COc1cc(Br)c(C(F)(F)F)cc1CCN	C10H11BrF3NO	unknown
+COc1cc(Br)c(I)cc1CCN	C9H11BrINO	unknown
+COc1cc(Br)c(OC(C)C)cc1CCN	C12H18BrNO2	unknown
+COCCOc1cc(CCN)c(OC)cc1Br	C12H18BrNO3	unknown
+COc1cc(C2COC2)c(OC)cc1CCNCc1ccccc1OC	C21H27NO4	unknown
+COc1cc(C2CCOC2)c(OC)cc1CCNCc1ccccc1OC	C22H29NO4	unknown
+COc1cc(C2CCCO2)c(OC)cc1CCNCc1ccccc1OC	C22H29NO4	unknown
+COCc1cc(OC)c(CCNCc2ccccc2OC)cc1OC	C20H27NO4	unknown
+CCOCc1cc(OC)c(CCNCc2ccccc2OC)cc1OC	C21H29NO4	unknown
+COc1cc(C2(OC)COC2)c(OC)cc1CCNCc1ccccc1OC	C22H29NO5	unknown
+CCOCc1cc(OC)c(CCN)cc1OC	C13H21NO3	prophetic
+COc1cc(C2(OC)COC2)c(OC)cc1CCN	C14H21NO4	unknown
+COc1cc(C2COC2)c(OC)cc1CCN	C13H19NO3	prophetic
+COc1cc(CC(C)N)c(O)cc1Br	C10H14BrNO2	unknown
+COc1cc(CC(C)N)c(OCc2ccccc2)cc1Br	C17H20BrNO2	unknown
+CCCNC(C)Cc1cc(OC)ccc1OC	C14H23NO2	unknown
+CCOC(=O)Cc1cc(OC)c(CC(C)N)cc1OC	C15H23NO4	unknown
+COc1cc(CC(C)N)c(OC)cc1Cc1ncno1	C14H19N3O3	unknown
+COCCc1cc(OC)c(CC(C)N)cc1OC	C14H23NO3	unknown
+COc1cc(CC(C)N)c(OC)cc1CCSC	C14H23NO2S	unknown
+COc1cc(CC(C)N)c(OC)cc1CCCSC	C15H25NO2S	unknown
+COCCCc1cc(OC)c(CC(C)N)cc1OC	C15H25NO3	unknown
+COCSCCc1cc(OC)c(CC(C)N)cc1OC	C15H25NO3S	unknown
+COc1cc(C)c(OC(C)=O)cc1CC(C)N	C13H19NO3	unknown
+COc1cc(CC(C)N)c(OC)cc1CC1=NCCS1	C15H22N2O2S	unknown
+COc1cc(CC(C)N)c(OC)cc1Cc1ccco1	C16H21NO3	unknown
+COc1cc(CC2CCCO2)c(OC)cc1CC(C)N	C16H25NO3	unknown
+COc1cc(CC2CCCS2)c(OC)cc1CC(C)N	C16H25NO2S	unknown
+COc1cccc(Cc2cc(OC)c(CC(C)N)cc2OC)c1	C19H25NO3	unknown
+COc1cc(CC(C)N)c(OC)cc1CCS(C)=O	C14H23NO3S	unknown
+NC1(c2ccccc2)CCCCCC1	C13H19N	arylcycloalkylamine
+COc1ccc(Cc2cc(OC)c(CC(C)N)cc2OC)cc1	C19H25NO3	unknown
+COc1ccccc1Cc1cc(OC)c(CC(C)N)cc1OC	C19H25NO3	unknown
+COc1cc(CC(C)N)c(OC)cc1Cc1ccc(Cl)cc1	C18H22ClNO2	unknown
+c1ccc2c(c1)CCNCC2	C10H13N	unknown
+COc1cc2c(cc1Cl)CCNCC2C	C12H16ClNO	unknown
+CCC1CNCCc2ccc(Cl)cc21	C12H16ClN	unknown
+CC1(C)CNCCc2ccc(Cl)cc21	C12H16ClN	unknown
+COc1cccc(Cc2ccc3c(c2)C(C)CNCC3)c1	C19H23NO	unknown
+CC1CNCCc2cc(O)c(Cc3cccc(F)c3)cc21	C18H20FNO	unknown
+COc1cccc(Cc2ccc3c(c2)CCNCC3)c1	C18H21NO	unknown
+Oc1cccc(Cc2ccc3c(c2)CCNCC3)c1	C17H19NO	unknown
+COc1cc(Cc2ccc3c(c2)CCNCC3)cc(OC)c1	C19H23NO2	unknown
+Oc1cccc(Cc2cc3c(cc2O)CCNCC3)c1	C17H19NO2	unknown
+Oc1ccc(Cc2cc3c(cc2O)CCNCC3)cc1	C17H19NO2	unknown
+COc1cccc(OCc2ccc3c(c2)CCNCC3)c1	C18H21NO2	unknown
+Oc1cccc(OCc2ccc3c(c2)CCNCC3)c1	C17H19NO2	unknown
+COc1cccc(OCc2cc3c(cc2C)CCNCC3)c1	C19H23NO2	unknown
+CC(N)Cc1c[nH]c2ccc(Cl)cc12	C11H13ClN2	tryptamine
+C[C@H](N)Cn1ccc2cc(F)c(Cl)cc21	C11H12ClFN2	unknown
+COc1ccc2c(c1)C1C(C=CN1C[C@H](C)N)C2	C15H20N2O	unknown
+CC(N)Cn1ncc2cc(F)ccc21	C10H12FN3	unknown
+CC(N)Cn1ncc2ccc(F)cc21	C10H12FN3	unknown
+COc1ccc2cnn(C[C@H](C)N)c2c1	C11H15N3O	unknown
+COc1ccc2cnn(CC(C)N)c2c1Cl	C11H14ClN3O	unknown
+CC(N)Cn1ncc2cc(Cl)c(Cl)cc21	C10H11Cl2N3	unknown
+CC(N)Cn1ncc2ccc(Cl)c(Cl)c21	C10H11Cl2N3	unknown
+CC(N)Cn1ncc2ccc3sccc3c21	C12H13N3S	unknown
+CC(N)Cn1ncc2ccc3occc3c21	C12H13N3O	unknown
+CC(N)Cn1ncc2ccc3ocnc3c21	C11H12N4O	unknown
+Cc1nn(CC(C)N)c2c1ccc1occc12	C13H15N3O	unknown
+CCc1nn(CC(C)N)c2c1ccc1occc12	C14H17N3O	unknown
+CCCc1nn(CC(C)N)c2c1ccc1occc12	C15H19N3O	unknown
+COc1nn(CC(C)N)c2c1ccc1occc12	C13H15N3O2	unknown
+Cc1cc2c(ccc3cnn(CC(C)N)c32)o1	C13H15N3O	unknown
+CCc1cc2c(ccc3cnn(CC(C)N)c32)o1	C14H17N3O	unknown
+CC(N)Cn1ncc2ccc3oc(C(C)C)cc3c21	C15H19N3O	unknown
+CCc1cc2c(ccc3c(C)nn(CC(C)N)c32)o1	C15H19N3O	unknown
+CCc1cc2c(ccc3c(CC)nn(CC(C)N)c32)o1	C16H21N3O	unknown
+CCc1cc2c(ccc3c(OC)nn(CC(C)N)c32)o1	C15H19N3O2	unknown
+O=[N+]([O-])c1ccc2c(c1Cl)CCNCC2	C10H11ClN2O2	unknown
+N#Cc1ccc2c(c1Cl)CCNCC2	C11H11ClN2	unknown
+Clc1c(Br)ccc2c1CCNCC2	C10H11BrClN	unknown
+COc1ccc2c(c1Cl)CCNCC2	C11H14ClNO	unknown
+CNc1ccc2c(c1Cl)CCNCC2	C11H15ClN2	unknown
+c1cc2ccc3c(c2o1)CCNCC3	C12H13NO	unknown
+c1cc2c3c(ccc2o1)CCNCC3	C12H13NO	unknown
+c1cc2cc3c(cc2o1)CCNCC3	C12H13NO	unknown
+CCNc1c2c(nc3ccnn13)CCNCC2	C12H17N5	unknown
+c1cncc(OC2CN(c3c4c(nc5ccnn35)CCNCC4)C2)c1	C18H20N6O	unknown
+Fc1ccc(Cc2nc3c(c(-c4ccc(F)cc4)n2)CCNCC3)cc1	C21H19F2N3	unknown
+CN1CCc2cc(Cl)c(O)cc2[C@@H](c2ccccc2)C1	C17H18ClNO	unknown
+Oc1cc2c(cc1O)C(c1ccccc1)CNCC2	C16H17NO2	unknown
+C=CCN1CCc2cc(O)c(O)cc2[C@@H](c2ccccc2)C1	C19H21NO2	unknown
+Oc1cc2c(c(Cl)c1O)CCNC[C@@H]2c1ccccc1	C16H16ClNO2	unknown
+C=CCN1CCc2c(cc(O)c(O)c2Cl)[C@@H](c2ccccc2)C1	C19H20ClNO2	unknown
+Cc1cccc(C2CN(C)CCc3c2cc(O)c(O)c3Cl)c1	C18H20ClNO2	unknown
+C=CCN1CCc2c(cc(O)c(O)c2Br)[C@@H](c2ccccc2)C1	C19H20BrNO2	unknown
+Oc1ccc(C2CNCCc3c2cc(O)c(O)c3Cl)cc1	C16H16ClNO3	unknown
+O=c1c2c(on1Cc1ccccc1)CCNCC2	C14H16N2O2	unknown
+O=c1c2c(on1Cc1ccc(F)cc1)CCNCC2	C14H15FN2O2	unknown
+CCOc1noc2c1CCNCC2	C9H14N2O2	unknown
+c1ccc(COc2noc3c2CCNCC3)cc1	C14H16N2O2	unknown
+Fc1ccc2[nH]c3c(c2c1)CCNCC3	C12H13FN2	unknown
+c1ccc2c3c([nH]c2c1)CCNCC3	C12H14N2	unknown
+Cn1c2c(c3ccccc31)CCNCC2	C13H16N2	unknown
+c1cc2c3c(c1)c1c(n3CCO2)CCNCC1	C14H16N2O	unknown
+c1ccc2c(c1)cc1n2CCNCC1	C12H14N2	unknown
+CN1CCc2cc3ccccc3n2CC1	C13H16N2	unknown
+COc1cc(CCNCc2ccccc2OCCF)c(OC)cc1Br	C19H23BrFNO3	unknown
+CCN1CCc2cc3ccccc3n2CC1	C14H18N2	unknown
+Clc1c2n(c3ccccc13)CCNCC2	C12H13ClN2	unknown
+Cc1c2n(c3ccccc13)CCNCC2	C13H16N2	unknown
+NC(=O)c1c2n(c3ccccc13)CCNCC2	C13H15N3O	unknown
+CCOc1ccccc1-c1cccc2c1N1CCNCCC1C2	C20H24N2O	unknown
+CCOc1ccccc1-c1cc(Cl)cc2c1N1CCNCCC1C2	C20H23ClN2O	unknown
+CCOc1cccc(-c2cc(Cl)cc3c2N2CCNCCC2C3)c1	C20H23ClN2O	unknown
+CCOc1ccc(-c2cc(Cl)cc3c2N2CCNCCC2C3)cc1	C20H23ClN2O	unknown
+Fc1ccccc1-c1cc(Cl)cc2c1N1CCNCCC1C2	C18H18ClFN2	unknown
+Fc1ccc(-c2cc(Cl)cc3c2N2CCNCCC2C3)cc1	C18H18ClFN2	unknown
+Clc1ccc(Cl)c(-c2cc(Cl)cc3c2N2CCNCCC2C3)c1	C18H17Cl3N2	unknown
+CCOc1ccccc1-c1cc(Cl)cc2cc3n(c12)CCNCC3	C20H21ClN2O	unknown
+CCN(CC)C(=O)CCNC(C)Cc1cc(OC)c(OC)cc1OC	C19H32N2O4	unknown
+CCN(CC)C(=O)CCNCCc1ccc(OC)c(OC)c1	C17H28N2O3	unknown
+CCN(CC)C(=O)CCNC(C)Cc1cc(OC)c(OC)c(OC)c1	C19H32N2O4	unknown
+COc1cc(CCNCc2ccccc2Cl)c(OC)cc1Cl	C17H19Cl2NO2	unknown
+COc1cc(CCNCc2cc(Cl)ccc2OC)c(OC)cc1Cl	C18H21Cl2NO3	unknown
+COc1ccc(CCNCc2ccsc2)cc1OC	C15H19NO2S	unknown
+COc1cc(CCNCc2ccsc2)c(OC)cc1C	C16H21NO2S	unknown
+COc1cc(CCNCc2ccccc2Cl)cc(OC)c1OC	C18H22ClNO3	unknown
+CCN(CC)C(=O)CCNC(C)Cc1cc(OC)c(C)cc1OC	C19H32N2O3	unknown
+COc1ccc(OC)c(CNCCc2cc(OC)c(Cl)cc2OC)c1	C19H24ClNO4	unknown
+COc1ccc(OC)c(CNCCc2cc(OC)c(C)cc2OC)c1	C20H27NO4	unknown
+CCOc1ccc(Cl)cc1CNCCc1cc(OC)c(Cl)cc1OC	C19H23Cl2NO3	unknown
+CCOc1ccc(Cl)cc1CNCCc1cc(OC)c(OC)c(OC)c1	C20H26ClNO4	unknown
+COc1cc(CCN)c(OC)cc1S	C10H15NO2S	unknown
+COc1cc(S(F)(F)F)c(OC)cc1CCN	C10H14F3NO2S	unknown
+COc1cc(S(F)(F)(F)(F)F)c(OC)cc1CCN	C10H14F5NO2S	prophetic
+COc1cc(SC(F)(F)C(F)(F)F)c(OC)cc1CCN	C12H14F5NO2S	unknown
+COc1cc(SCS(F)(F)(F)(F)F)c(OC)cc1CCN	C11H16F5NO2S2	unknown
+COc1cc(SCCS(F)(F)(F)(F)F)c(OC)cc1CCN	C12H18F5NO2S2	unknown
+COc1cc(CCNCc2ccc3ccccc3c2Br)c(OC)cc1Cl	C21H21BrClNO2	unknown
+COc1ccc(CCNCc2ccccc2Cl)cc1OC	C17H20ClNO2	unknown
+COc1ccccc1C(Cc1ccccc1)N1CCCCC1	C20H25NO	unknown
+CN(C)CCCOc1nn(Cc2ccccc2)c2ccccc12	C19H23N3O	unknown
+NCc1cc(O)no1	C4H6N2O2	unknown
+N[C@H](C(=O)O)c1cc(O)no1	C5H6N2O4	unknown
+NCC(CC(=O)O)c1ccc(F)cc1	C10H12FNO2	unknown
+CC1NCCOC1c1cccc(F)c1	C11H14FNO	unknown
+COC(=O)C(c1ccc(F)cc1)C1CCCCN1	C14H18FNO2	unknown
+COC(=O)C(c1ccc(C)cc1)C1CCCCN1	C15H21NO2	unknown
+COC(=O)C(c1ccccc1)C1COCCN1	C13H17NO3	unknown
+CCOC(=O)C(c1ccc2ccccc2c1)C1CCCCN1	C19H23NO2	unknown
+CCOC(=O)C(c1ccc(F)cc1)C1CCCCN1	C15H20FNO2	unknown
+CC(C)OC(=O)C(c1ccccc1)C1CCCCN1	C16H23NO2	unknown
+CCCOC(=O)C(c1ccccc1)C1CCCCN1	C16H23NO2	unknown
+COc1cc(C(CN)CC(=O)O)cc(OC)c1OC	C13H19NO5	unknown
+c1ccc(CC(c2ccccc2)N2CCCCC2)cc1	C19H23N	unknown
+Cc1ccc(C(CN)CC(=O)O)cc1	C11H15NO2	unknown
+CCCCC(NC)C(=O)c1ccccc1	C13H19NO	beta-ketone
+CCCCC(NCC)C(=O)c1ccccc1	C14H21NO	beta-ketone
+CCCCC(C(=O)c1ccccc1)N1CCCC1	C16H23NO	beta-ketone
+O=c1[nH]oc2c1CCNC2	C6H8N2O2	unknown
+CCCC(NCC)C(=O)c1ccccc1	C13H19NO	beta-ketone
+CCCC(C(=O)c1ccc2c(c1)CCO2)N1CCCC1	C17H23NO2	beta-ketone
+COC(=O)C(c1ccc(Cl)c(Cl)c1)C1CCCC1	C14H16Cl2O2	unknown
+CNC(C)C(=O)c1cccc(Cl)c1	C10H12ClNO	beta-ketone
+CNC(C)Cc1ccc2ccccc2c1	C14H17N	unknown
+CC1NC(C)(C)COC1(O)c1cccc(Cl)c1	C13H18ClNO2	unknown
+CNC(COC)C(=O)c1ccc(C)cc1	C12H17NO2	beta-ketone
+CCNC(C)C(=O)c1cc(C)c2c(c1)OCO2	C13H17NO3	beta-ketone
+CCCC(NC)C(=O)c1ccc(C)cc1	C13H19NO	beta-ketone
+CNC(C)C(=O)c1cccs1	C8H11NOS	unknown
+O=C(c1ccc2c(c1)CCC2)C(c1ccccc1)N1CCCC1	C21H23NO	beta-ketone
+CCNC(C)C(=O)c1cccc(Cl)c1	C11H14ClNO	beta-ketone
+CCNC(C)C(=O)c1cccc(C)c1	C12H17NO	beta-ketone
+Oc1cccc2[nH]ccc12	C8H7NO	unknown
+CC(=O)Oc1cccc2[nH]ccc12	C10H9NO2	unknown
+COC(=O)Cc1c[nH]c2cccc(Cl)c12	C11H10ClNO2	unknown
+N[C@@H](Cc1c[nH]c2cccc(O)c12)C(=O)O	C11H12N2O3	tryptamine
+C[N+](C)(C)CCc1c[nH]c2ccccc12	C13H19N2	tryptamine
+NCCc1c[nH]c2ccc(Br)cc12	C10H11BrN2	tryptamine
+COc1cccc(C(Cc2ccccc2)N2CCCCC2)c1	C20H25NO	unknown
+COc1ccc(C(Cc2ccccc2)N2CCCCC2)cc1	C20H25NO	unknown
+c1ccc(CC(c2ccccc2)N2CCCC2)cc1	C18H21N	unknown
+c1ccc(C(CN2CCCC2)c2ccccc2)cc1	C18H21N	unknown
+c1ccc(C(CN2CCCCC2)c2ccccc2)cc1	C19H23N	unknown
+Cc1[nH]c2ccc(F)cc2c1CC(C)N	C12H15FN2	tryptamine
+Cc1ccc2[nH]cc(CC(C)N)c2c1	C12H16N2	tryptamine
+OC(c1ccccc1)(c1ccccc1)C1CCNCC1	C18H21NO	unknown
+c1ccc(C2(N3CCCCC3)CCCCC2)cc1	C17H25N	arylcycloalkylamine
+CNC1(c2ccccc2Cl)CCCCC1=O	C13H16ClNO	arylcycloalkylamine
+C#CCNC1CCc2ccccc21	C12H13N	unknown
+CN(C)CCCN1c2ccccc2CCc2ccccc21	C19H24N2	unknown
+COc1cccc(C2(N3CCCCC3)CCCCC2)c1	C18H27NO	arylcycloalkylamine
+Clc1ccccc1C1(N2CCCCC2)CCCCC1	C17H24ClN	arylcycloalkylamine
+C[C@]12N[C@H](Cc3ccccc31)c1ccccc12	C16H15N	arylcycloalkylamine
+CN(C)[C@@H]1CCCC[C@H]1N(C)C(=O)c1ccc(Cl)c(Cl)c1	C16H22Cl2N2O	unknown
+CN(C)[C@@H]1CCCC[C@H]1N(C)C(=O)Cc1ccc(Cl)c(Cl)c1	C17H24Cl2N2O	unknown
+COc1cccc(C2OCCNC2C)c1	C12H17NO2	unknown
+CCOC(=O)C(c1ccc(Cl)c(Cl)c1)C1CCCCN1	C15H19Cl2NO2	unknown
+CCOC(=O)C(c1ccccc1)C1CCCCN1Cc1ccccc1	C22H27NO2	unknown
+CC[C@@H]1CN2CC[C@@]3(O)C(=Nc4cccc(OC)c43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC	C23H30N2O5	unknown
+C=C[C@H]1CN2CCc3c([nH]c4cccc(OC)c34)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC	C23H28N2O4	unknown
+CC[C@H]1CN2CCc3c([nH]c4cccc(OC)c34)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC	C23H30N2O4	unknown
+CC[C@@H]1CN2CCc3c([nH]c4cccc(OC)c34)[C@H]2C[C@@H]1/C(=C\OC)C(=O)OC	C23H30N2O4	unknown
+CC[C@@H]1CN2CCc3c([nH]c4ccccc34)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC	C22H28N2O3	unknown
+CC(N)Cc1c[nH]c2ccc3ccccc3c12	C15H16N2	tryptamine
+CC(N)Cn1ccc2c3ccccc3ccc21	C15H16N2	unknown
+CCN(CC)C(=O)CCN(C)C1Cc2cccc3[nH]cc(c23)C1	C19H27N3O	unknown
+CCNC(CC)C(=O)c1ccc(C)c(C)c1	C14H21NO	beta-ketone
+CCCC(NCC)C(=O)c1ccc(C)c(C)c1	C15H23NO	beta-ketone
+CCCC(C(=O)c1ccc(C)c(C)c1)N1CCCC1	C17H25NO	beta-ketone
+CCCC(NCC)C(=O)c1ccc(F)cc1	C13H18FNO	beta-ketone
+CCCC(NCC)C(=O)c1ccc2c(c1)CCC2	C16H23NO	beta-ketone
+CCNC(CC)C(=O)c1ccc2c(c1)CCC2	C15H21NO	beta-ketone
+COc1ccccc1CNCCn1c(=O)[nH]c2ccccc2c1=O	C18H19N3O3	unknown
+NC(Cc1ccccn1)c1ccccc1	C13H14N2	unknown
+c1ccc(C2(N3CCCC3)CCCCC2)cc1	C16H23N	arylcycloalkylamine
+CCNC(Cc1ccccn1)c1ccccc1	C15H18N2	unknown
+CC(C)=CCN1CCN(C(Cc2cccc(O)c2)c2ccccc2)CC1	C23H30N2O	unknown
+CN(C)C1(CNC(=O)c2ccc(Cl)c(Cl)c2)CCCCC1	C16H22Cl2N2O	unknown
+CCn1cc(C(=O)O)c(=O)c2ccc(Cc3ccccc3)nc21	C18H16N2O3	unknown
+Cc1ccc(-c2c(C)[n+](C)c(C)n2C)cc1	C14H19N2	unknown
+c1ccc(N2CCCCC2)cc1	C11H15N	unknown
+CC(Cc1ccc2c(c1)OCO2)N(C)C(=O)OC(C)(C)C	C16H23NO4	unknown
+CCCC(=O)N(c1ccc(F)cc1)C1CCN(CCc2ccccc2)CC1	C23H29FN2O	fentanyl
+C=CC(=O)N(c1ccccc1)C1CCN(CCc2ccccc2)CC1	C22H26N2O	fentanyl
+CON(C)C(C)C(=O)c1ccc(C)cc1	C12H17NO2	beta-ketone
+Brc1ccc(NC2C3CC4CC(C3)CC2C4)cc1	C16H20BrN	unknown
+c1csc(C2(N3CCCCC3)CCCCC2)c1	C15H23NS	arylcycloalkylamine
+CCNC1(c2cccs2)CCCCC1=O	C12H17NOS	arylcycloalkylamine
+c1ccc(C2CCCCN2)cc1	C11H15N	unknown
+c1ccc(Cc2ccccn2)cc1	C12H11N	unknown
+C1CCC(CC2CCCCN2)CC1	C12H23N	unknown
+CCCNC1(c2ccccc2)CCCCC1	C15H23N	arylcycloalkylamine
+COCCNC1(c2ccccc2)CCCCC1	C15H23NO	arylcycloalkylamine
+CCOCCNC1(c2ccccc2)CCCCC1	C16H25NO	arylcycloalkylamine
+COCCCNC1(c2ccccc2)CCCCC1	C16H25NO	arylcycloalkylamine
+c1csc(C2(N3CCCC3)CCCCC2)c1	C14H21NS	arylcycloalkylamine
+Cc1ccc(C2(N3CCCCC3)CCCCC2)cc1	C18H27N	arylcycloalkylamine
+c1ccc(CC2(N3CCCCC3)CCCCC2)cc1	C18H27N	unknown
+CC1CCN(C2(c3ccccc3)CCCCC2)CC1	C18H27N	arylcycloalkylamine
+c1ccc(C2(N3CCOCC3)CCCCC2)cc1	C16H23NO	arylcycloalkylamine
+COc1ccc(C2(N3CCCCC3)CCCCC2)cc1	C18H27NO	arylcycloalkylamine
+COc1cccc(C2(N3CCCC3)CCCCC2)c1	C17H25NO	arylcycloalkylamine
+CCNC1(c2cccc(OC)c2)CCCCC1	C15H23NO	arylcycloalkylamine
+CCCNC1(c2cccc(OC)c2)CCCCC1	C16H25NO	arylcycloalkylamine
+CCNC1(c2cccc(O)c2)CCCCC1	C14H21NO	arylcycloalkylamine
+Oc1cccc(C2(N3CCCCC3)CCCCC2)c1	C17H25NO	arylcycloalkylamine
+COc1cccc(C2(N3CCOCC3)CCCCC2)c1	C17H25NO2	arylcycloalkylamine
+C#CCC1(N2CCCCC2)CCCCC1	C14H23N	unknown
+C=CCC1(N2CCCCC2)CCCCC1	C14H25N	unknown
+CC(Cc1ccccc1)(NC(=O)CN)c1ccccc1	C17H20N2O	unknown
+C[C@@H]1CCCC[C@]1(c1cccs1)N1CCCCC1	C16H25NS	arylcycloalkylamine
+c1ccc(C2(c3ccccc3)OC[C@H]([C@@H]3CCCCN3)O2)cc1	C20H23NO2	arylcycloalkylamine
+CNCCC(c1cccc(F)c1)c1cccc(F)c1	C16H17F2N	unknown
+CC(CN)C(O)(c1ccccc1)c1ccccc1	C16H19NO	unknown
+CC(C(O)c1ccc(O)cc1)N1CCC(Cc2ccccc2)CC1	C21H27NO2	unknown
+CNC1(c2ccccc2F)CCCCC1=O	C13H16FNO	arylcycloalkylamine
+CCNC1(c2ccccc2Cl)CCCCC1=O	C14H18ClNO	arylcycloalkylamine
+c1ccc2sc(C3(N4CCCCC4)CCCCC3)cc2c1	C19H25NS	arylcycloalkylamine
+CNC1(c2ccccc2)CCCCC1=O	C13H17NO	arylcycloalkylamine
+NC1(c2ccccc2)CCCCC1	C12H17N	arylcycloalkylamine
+CNC1(c2ccccc2)CCCCC1	C13H19N	arylcycloalkylamine
+CNC(C)Cc1cc2ccccc2o1	C12H15NO	unknown
+CCC(Cc1ccc2occc2c1)NC	C13H17NO	unknown
+NCCc1ccc2c(c1)CCO2	C10H13NO	unknown
+CCC(C)NC1(c2ccccc2)CCCCC1	C16H25N	arylcycloalkylamine
+c1ccc(C2(N3CCCC3)CCCCCC2)cc1	C17H25N	arylcycloalkylamine
+CN(C)C1(c2ccccc2)CCCCC1	C14H21N	arylcycloalkylamine
+CCCCC(C(=O)c1ccc(OC)c(OC)c1)N1CCCC1	C18H27NO3	beta-ketone
+c1ccc(C2(N3CCCCCC3)CCCCC2)cc1	C18H27N	arylcycloalkylamine
+c1ccc(C2(N3CCCCC3)CCCCCC2)cc1	C18H27N	arylcycloalkylamine
+CCCCC(C(=O)c1ccc2c(c1)CCC2)N1CCCC1	C19H27NO	beta-ketone
+CCC[C@H](NC(=O)c1cn(Cc2ccc(F)cc2)c2ccccc12)C(=O)OC	C22H23FN2O3	cannabinoid
+O=C(C1CCCO1)N(c1ccccc1)C1CCN(CCc2ccccc2)CC1	C24H30N2O2	fentanyl
+CCCC(NC)C(=O)c1ccc(Cl)cc1	C12H16ClNO	beta-ketone
+CCCCCCC(C(=O)c1ccc2c(c1)OCO2)N1CCCC1	C19H27NO3	beta-ketone
+CCCCCC(C(=O)c1ccc(C)cc1)N1CCCC1	C18H27NO	beta-ketone
+CNC(C)C(=O)c1cc(OC)c2c(c1)OCO2	C12H15NO4	beta-ketone
+CN(C)C1(CNC(=O)c2ccccc2Cl)CCCCC1	C16H23ClN2O	unknown
+CC1N=C(N)OC1c1ccc2c(c1)OCO2	C11H12N2O3	unknown
+CCC1NCCOC1c1ccccc1	C12H17NO	unknown
+Cc1ccc(C2OCCNC2C)cc1	C12H17NO	unknown
+O=C(CCl)N1CCN(C(c2ccccc2)c2ccccc2)CC1	C19H21ClN2O	unknown
+CC(C)C(=O)N(c1ccc(F)cc1)C1CCN(CCc2ccccc2)CC1	C23H29FN2O	fentanyl
+c1ccc(CN2CCC(Nc3ccccc3)CC2)cc1	C18H22N2	unknown
+CC(CNCc1ccccc1O)c1ccccc1	C16H19NO	unknown
+CC(CN(C)C)c1ccccc1	C11H17N	unknown
+CCC(Cc1ccccc1)NC	C11H17N	unknown
+c1ccc(NC2CCNCC2)cc1	C11H16N2	unknown
+CCC(=O)N(c1ccccc1F)C1CCN(CCc2ccccc2)CC1	C22H27FN2O	fentanyl
+CNC(C)C(=O)c1cc2c(cc1OC)OCO2	C12H15NO4	beta-ketone
+CNC(Cc1ccc2c(c1)OCO2)c1ccccc1	C16H17NO2	unknown
+c1ccc2[nH]ccc2c1	C8H7N	unknown
+NCc1ccco1	C5H7NO	unknown
+Cc1nnc2n1-c1ccc(Cl)cc1C(c1ccccc1)=NC2	C17H13ClN4	aryldiazepine
+O=C1CN=C(c2ccccn2)c2cc(Br)ccc2N1	C14H10BrN3O	aryldiazepine
+Cc1nnc2n1-c1sc(Br)cc1C(c1ccccc1Cl)=NC2	C15H10BrClN4S	aryldiazepine
+CN(C)C(=O)OC1N=C(c2ccccc2)c2cc(Cl)ccc2N(C)C1=O	C19H18ClN3O3	aryldiazepine
+CNC1=Nc2ccc(Cl)cc2C(c2ccccc2)=[N+]([O-])C1	C16H14ClN3O	aryldiazepine
+O=C1CN=C(c2ccccc2Cl)c2cc([N+](=O)[O-])ccc2N1	C15H10ClN3O3	aryldiazepine
+O=C(O)C1N=C(c2ccccc2)c2cc(Cl)ccc2NC1=O	C16H11ClN2O3	aryldiazepine
+O=C1CN2CCOC2(c2ccccc2Cl)c2cc(Cl)ccc2N1	C17H14Cl2N2O2	aryldiazepine
+O=C1CN=C(c2ccccc2Cl)c2cc(Cl)ccc2N1	C15H10Cl2N2O	aryldiazepine
+CN1C(=O)CN=C(c2ccccc2)c2cc(Cl)ccc21	C16H13ClN2O	aryldiazepine
+CCOC(=O)C1N=C(c2ccccc2F)c2cc(Cl)ccc2NC1=O	C18H14ClFN2O3	aryldiazepine
+CN1C(=O)CN=C(c2ccccc2F)c2cc(Cl)ccc21	C16H12ClFN2O	aryldiazepine
+CCN(CC)CCN1C(=O)CN=C(c2ccccc2F)c2cc(Cl)ccc21	C21H23ClFN3O	aryldiazepine
+O=C1CN2CCOC2(c2ccccc2F)c2cc(Br)ccc2N1	C17H14BrFN2O2	aryldiazepine
+CC1=CC(=O)N2CC(=O)N(C)c3ccc(Cl)cc3C2(c2ccccc2)O1	C20H17ClN2O3	aryldiazepine
+CN1CCN(/C=C2\N=C3CN=C(c4ccccc4Cl)c4cc([N+](=O)[O-])ccc4N3C2=O)CC1	C23H21ClN6O3	aryldiazepine
+O=C1Nc2ccc(Cl)cc2C(c2ccccc2Cl)=NC1O	C15H10Cl2N2O2	aryldiazepine
+CN1C(=O)C(O)N=C(c2ccccc2Cl)c2cc(Cl)ccc21	C16H12Cl2N2O2	aryldiazepine
+CN1CCN=C(c2ccccc2)c2cc(Cl)ccc21	C16H15ClN2	aryldiazepine
+Cc1ncc2n1-c1ccc(Cl)cc1C(c1ccccc1F)=NC2	C18H13ClFN3	aryldiazepine
+CN1C(=O)CN=C(c2ccccc2)c2cc([N+](=O)[O-])ccc21	C16H13N3O3	aryldiazepine
+O=C1CN=C(c2ccccc2)c2cc([N+](=O)[O-])ccc2N1	C15H11N3O3	aryldiazepine
+O=C1CN=C(c2ccccc2)c2cc(Cl)ccc2N1	C15H11ClN2O	aryldiazepine
+CC1CN2CC(=O)Nc3ccc(Cl)cc3C2(c2ccccc2)O1	C18H17ClN2O2	aryldiazepine
+C#CCN1C(=O)CN=C(c2ccccc2)c2cc(Cl)ccc21	C18H13ClN2O	aryldiazepine
+Fc1ccccc1C1=NCC(=S)N(CC(F)(F)F)c2ccc(Cl)cc21	C17H11ClF4N2S	aryldiazepine
+CN1C(=O)C(O)N=C(c2ccccc2)c2cc(Cl)ccc21	C16H13ClN2O2	aryldiazepine
+CN1C(=O)CN=C(C2=CCCCC2)c2cc(Cl)ccc21	C16H17ClN2O	aryldiazepine
+Cc1nnc2n1-c1ccc(Cl)cc1C(c1ccccc1Cl)=NC2	C17H12Cl2N4	aryldiazepine
+CN1C(=O)CN=C(c2ccccc2F)c2cc([N+](=O)[O-])ccc21	C16H12FN3O3	aryldiazepine
+CCc1cc2c(s1)-n1c(C)nnc1CN=C2c1ccccc1	C17H16N4S	aryldiazepine
+CN1C(=O)CN=C(c2ccccc2Cl)c2cc(Cl)ccc21	C16H12Cl2N2O	aryldiazepine
+CCc1cc2c(s1)-n1c(C)nnc1CN=C2c1ccccc1Cl	C17H15ClN4S	aryldiazepine
+O=C1CN=C(c2ccccc2F)c2cc(Br)ccc2N1	C15H10BrFN2O	aryldiazepine
+Cc1nnc2n1-c1ccc(Br)cc1C(c1ccccc1F)=NC2	C17H12BrFN4	aryldiazepine
+O=C1CN=C(c2ccccc2Cl)c2cc(Br)ccc2N1	C15H10BrClN2O	aryldiazepine
+Cc1nnc2n1-c1ccc(Br)cc1C(c1ccccn1)=NC2	C16H12BrN5	aryldiazepine
+O=C1Nc2ccc(Br)cc2C(c2ccccc2Cl)=NC1O	C15H10BrClN2O2	aryldiazepine
+O=C1C[N+]([O-])=C(c2ccccc2Cl)c2cc(Br)ccc2N1	C15H10BrClN2O2	unknown
+O=C1CN=C(c2ccccc2)c2c(sc3c2CCCC3)N1	C17H16N2OS	aryldiazepine
+CN(C)Cc1nnc2n1-c1ccc(Cl)cc1C(c1ccccc1)=NC2	C19H18ClN5	aryldiazepine
+O=C1CN=C(c2ccccc2Cl)c2cc([N+](=O)[O-])ccc2N1CC1CC1	C19H16ClN3O3	aryldiazepine
+CCc1cc2c(s1)-n1cnnc1CN=C2c1ccccc1Cl	C16H13ClN4S	aryldiazepine
+CC(C)(C)C(=O)OC1N=C(c2ccccc2)c2cc(Cl)ccc2NC1=O	C20H19ClN2O3	aryldiazepine
+NC1(c2cccc(F)c2)CCCCCC1	C13H18FN	arylcycloalkylamine
+Cc1nnc2n1-c1ccc([N+](=O)[O-])cc1C(c1ccccc1)=NC2	C17H13N5O2	aryldiazepine
+C[C@@H]1N=C(c2ccccc2Cl)c2cc([N+](=O)[O-])ccc2NC1=O	C16H12ClN3O3	aryldiazepine
+O=C1Nc2ccc([N+](=O)[O-])cc2C(c2ccccc2F)=NC1O	C15H10FN3O4	aryldiazepine
+Fc1cccc(C2(N3CCCC3)CCCCCC2)c1	C17H24FN	arylcycloalkylamine
+NC1(c2ccc(F)cc2)CCCCCC1	C13H18FN	arylcycloalkylamine
+Fc1ccc(C2(N3CCCC3)CCCCCC2)cc1	C17H24FN	arylcycloalkylamine
+NC1(c2ccccc2)CC2CCC1C2	C13H17N	arylcycloalkylamine
+c1ccc(C2(N3CCCCC3)CC3CCC2C3)cc1	C18H25N	arylcycloalkylamine
+c1ccc(C2(N3CCCC3)CC3CCC2C3)cc1	C17H23N	arylcycloalkylamine
+NC1(c2ccccc2F)CC2CCC1C2	C13H16FN	arylcycloalkylamine
+NC1(c2cccc(F)c2)CC2CCC1C2	C13H16FN	arylcycloalkylamine
+NC1(c2ccc(F)cc2)CC2CCC1C2	C13H16FN	arylcycloalkylamine
+Fc1ccccc1C1(N2CCCCC2)CC2CCC1C2	C18H24FN	arylcycloalkylamine
+Fc1ccc(C2(N3CCCCC3)CC3CCC2C3)cc1	C18H24FN	arylcycloalkylamine
+Fc1ccc(C2(N3CCCC3)CC3CCC2C3)cc1	C17H22FN	arylcycloalkylamine
+FC(F)(F)c1ccc(C2(N3CCCCC3)CC3CCC2C3)cc1	C19H24F3N	arylcycloalkylamine
+FC(F)(F)c1ccc(C2(N3CCCC3)CC3CCC2C3)cc1	C18H22F3N	arylcycloalkylamine
+COc1cccc(C2(CN3CCOCC3)CCCCC2)c1	C18H27NO2	unknown
+NC1(c2ccc(C(F)(F)F)cc2)CC2CCC1C2	C14H16F3N	arylcycloalkylamine
+COc1ccc2[nH]cc(C3=CCNCC3)c2c1	C14H16N2O	unknown
+C=CC1(N2CCCCC2)CCCCC1	C13H23N	unknown
+c1cc(C2(N3CCCCC3)CCCCC2)cs1	C15H23NS	arylcycloalkylamine
+C=CCNC1(c2ccccc2)CCCCC1	C15H21N	arylcycloalkylamine
+CCOCCCNC1(c2ccccc2)CCCCC1	C17H27NO	arylcycloalkylamine
+COc1ccc2[nH]c(C)c(CCN3CCCC3)c2c1	C16H22N2O	tryptamine
+COc1ccc2[nH]c(C)c(CCN3CCCCC3)c2c1	C17H24N2O	tryptamine
+CC(C)N(CCc1c(-c2ccccc2)[nH]c2ccccc12)C(C)C	C22H28N2	tryptamine
+CN(C)CCc1c(-c2ccccc2)[nH]c2ccccc12	C18H20N2	tryptamine
+C=CCN(CC=C)CCc1c[nH]c2cccc(OCc3ccccc3)c12	C23H26N2O	tryptamine
+CCCN(CCC)CCc1c[nH]c2cccc(OCc3ccccc3)c12	C23H30N2O	tryptamine
+NC1Cc2cccc3[nH]cc(c23)C1	C11H12N2	unknown
+CN(C)C1Cc2cccc3[nH]cc(c23)C1	C13H16N2	unknown
+CN1CC=C(c2c[nH]c3ccccc23)CC1	C14H16N2	unknown
+COc1ccc2[nH]cc(C3=CCN(C)CC3)c2c1	C15H18N2O	unknown
+Cc1[nH]c2ccccc2c1C1=CCN(C)CC1	C15H18N2	unknown
+COc1ccc2[nH]c(C)c(C3=CCN(C)CC3)c2c1	C16H20N2O	unknown
+NCC1CCc2cccc3[nH]cc1c23	C12H14N2	unknown
+COc1cc(CCNCc2ccccc2OC)c(O)cc1Br	C17H20BrNO3	unknown
+CC(=O)C(c1ccccc1)C1CCN(CCc2ccccc2)CC1	C22H27NO	unknown
+CCC(=O)N(c1ccccc1)C1CCN(CCc2ccccc2)CC1C	C23H30N2O	fentanyl
+CCC(=O)N(c1ccc(F)cc1)C1CCN(CCc2ccccc2)CC1	C22H27FN2O	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CC(O)c2ccccc2)CC1	C22H28N2O2	fentanyl
+CC(=O)N(c1ccccc1)C1CCN(C(C)Cc2ccccc2)CC1	C22H28N2O	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CCc2cccs2)CC1	C20H26N2OS	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CC(O)c2ccccc2)CC1C	C23H30N2O2	fentanyl
+Nc1ccccc1	C6H7N	unknown
+CCC(=O)N(c1ccccc1)C1CCN(C(C)Cc2cccs2)CC1	C21H28N2OS	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CCc2cccs2)CC1C	C21H28N2OS	fentanyl
+CCC(=O)N(c1ccccc1)C1(C(=O)OC)CCN(CCC(=O)OC)CC1	C20H28N2O5	fentanyl
+CN(CCCCCc1ccccc1)Cc1ccccc1	C19H25N	unknown
+c1ccc(CCCCCN2CCCC2)cc1	C15H23N	unknown
+c1ccc(CCCCCN2CCCCC2)cc1	C16H25N	unknown
+CN(C)CCCCCC1CCCCC1	C13H27N	unknown
+C/C=N/Nc1ccccc1	C8H10N2	unknown
+N=C(N)NCCN1CCCCCCC1	C10H22N4	unknown
+CC(C)(C)NCC(O)COc1ccccc1C1CCCC1	C18H29NO2	unknown
+CNC(C)C(SSC(c1ccccc1)C(C)NC)c1ccccc1	C20H28N2S2	unknown
+NC1C2CCc3ccccc3C12	C11H13N	unknown
+NCC1(Cc2ccccc2)CC1	C11H15N	unknown
+NC1CC1CCc1ccccc1	C11H15N	unknown
+NC12CCC(c3ccccc3)(CC1)CC2	C14H19N	unknown
+c1ccc(N2CC2)cc1	C8H9N	unknown
+CC1OC(N)=NC1c1ccccc1	C10H12N2O	unknown
+NC1=NC(c2ccccc2)CO1	C9H10N2O	unknown
+NC1=NC(c2ccccc2)CS1	C9H10N2S	unknown
+OC(c1ccccc1)(c1ccccc1)C1COCCN1	C17H19NO2	unknown
+CCCN1CCCC(c2cccc(O)c2)C1	C14H21NO	unknown
+c1ccc(C2CCNCC2)cc1	C11H15N	unknown
+c1ccc(CCCCN2CCC(c3ccccc3)CC2)cc1	C21H27N	unknown
+c1ccc(C2(c3ccccc3)CCNCC2)cc1	C17H19N	unknown
+CN1CCC(c2ccccc2)(c2ccccc2)CC1	C18H21N	unknown
+CCN1CCC(c2ccccc2)(c2ccccc2)CC1	C19H23N	unknown
+CC(C)N1CCC(c2ccccc2)(c2ccccc2)CC1	C20H25N	unknown
+CC(C)(C)N1CCC(c2ccccc2)(c2ccccc2)CC1	C21H27N	unknown
+CCC(=O)OC1(c2ccccc2)CCN(C)CC1C	C16H23NO2	unknown
+CCCCCCCCCC(=O)OC1(c2ccc(Cl)cc2)CCN(CCCC(=O)c2ccc(F)cc2)CC1	C31H41ClFNO3	unknown
+c1csc(CN2CCNCC2)c1	C9H14N2S	unknown
+NC1Cc2ccccc21	C8H9N	unknown
+NC1CCc2ccccc21	C9H11N	unknown
+C#CCN(C)C1CCc2ccccc21	C13H15N	unknown
+C#CCN(C)C1CCCc2ccccc21	C14H17N	unknown
+C#CCN(C)C1CCCCc2ccccc21	C15H19N	unknown
+C#CCN(C)C1Cc2cccc3cccc1c23	C16H15N	unknown
+CCN(C)C(=O)Oc1cccc(C(C)N(C)C)c1	C14H22N2O2	unknown
+C#CCNC1CCc2ccc(OC(=O)N(C)CC)cc21	C16H20N2O2	unknown
+NC1CCCc2ccccc21	C10H13N	unknown
+c1ccc(CCCNC2CCc3ccccc3CC2)cc1	C20H25N	unknown
+CC1(N)C(=O)CCc2ccccc21	C11H13NO	unknown
+CC1(N)CCc2ccccc2C1=O	C11H13NO	unknown
+NC1CCCCc2ccccc21	C11H15N	unknown
+NC1CCc2ccccc2CC1	C11H15N	unknown
+NC1CC2CC1c1ccccc12	C11H13N	unknown
+NC1Cc2ccccc2C2CCCCC12	C14H19N	unknown
+CN1CCCC2CCc3ccccc3C21	C14H19N	unknown
+CN1CCc2cccc3c2C1CC3	C12H15N	unknown
+CN1CCCC2Cc3ccccc3CC21	C14H19N	unknown
+CN1CCCC2c3ccccc3CCC21	C14H19N	unknown
+NC1CC2CCC1c1ccccc12	C12H15N	unknown
+c1ccc2c(c1)C1CNC2C1	C10H11N	unknown
+c1ccc2c(c1)C1CCC2NC1	C11H13N	unknown
+c1ccc2c(c1)CC1CCC2N1	C11H13N	unknown
+c1ccc2c(c1)C1CCNC2C1	C11H13N	unknown
+c1cc2c3c(c1)CCC3NCC2	C11H13N	unknown
+NCC1c2ccccc2CCc2ccccc21	C16H17N	unknown
+NCC1c2ccccc2-c2ccccc21	C14H13N	unknown
+NCc1c2ccccc2cc2ccccc12	C15H13N	unknown
+NCC12CCC(c3ccccc31)c1ccccc12	C17H17N	unknown
+NCC12CC(c3ccccc31)c1ccccc12	C16H15N	unknown
+NCC1CC2c3ccccc3C1c1ccccc12	C17H17N	unknown
+NC1CC2c3ccccc3C1c1ccccc12	C16H15N	unknown
+c1ccc2c(c1)C1c3ccccc3C2C2NC12	C16H13N	unknown
+CN(C)CCCN1c2ccccc2Sc2ccc(Cl)cc21	C17H19ClN2S	unknown
+CN(C)CCOC(c1ccccc1)c1ccccc1	C17H21NO	unknown
+CN1CCC(=C2c3ccccc3C=Cc3ccccc32)CC1	C21H21N	unknown
+COC(=O)C(c1ccccc1)C1CCCCO1	C14H18O3	unknown
+COC(=O)C(c1ccccc1)C1CCCCC1	C15H20O2	unknown
+CN1CCC(=C2c3ccccc3Cc3ccccc32)CC1	C20H21N	unknown
+CN1CCC(=C2c3ccccc3CCc3ccccc32)CC1	C21H23N	unknown
+NCC1c2ccccc2C=Cc2ccccc21	C16H15N	unknown
+NCC1c2ccccc2Oc2ccccc21	C14H13NO	unknown
+CN1CCC(=C2c3ccccc3Oc3ccccc32)CC1	C19H19NO	unknown
+NCC1c2ccccc2Sc2ccccc21	C14H13NS	unknown
+CN1CCC(=C2c3ccccc3Sc3ccccc32)CC1	C19H19NS	unknown
+CN(C)CCCC1c2ccccc2Cc2ccccc21	C19H23N	unknown
+NC1c2ccccc2Cc2ccccc21	C14H13N	unknown
+COc1cccc2c(C(=O)N[C@H](C)Cc3ccccc3)cn(CCN3CCOCC3)c12	C25H31N3O3	cannabinoid
+CNCCC1c2ccccc2Cc2ccccc21	C17H19N	unknown
+CN(C)CCC1c2ccccc2Cc2ccccc21	C18H21N	unknown
+NCCCC1c2ccccc2Cc2ccccc21	C17H19N	unknown
+CNCCCC1c2ccccc2Cc2ccccc21	C18H21N	unknown
+NCCCC(c1ccccc1)c1ccccc1	C16H19N	unknown
+CNCCCC(c1ccccc1)c1ccccc1	C17H21N	unknown
+CN(C)CCCC(c1ccccc1)c1ccccc1	C18H23N	unknown
+c1ccc2c(c1)Cc1ccccc1C21CCNC1	C17H17N	unknown
+c1ccc2c(c1)Cc1ccccc1C21CCCNC1	C18H19N	unknown
+c1ccc2c(c1)CCc1ccccc1C21CCNC1	C18H19N	unknown
+c1ccc(C2(c3ccccc3)CCNC2)cc1	C16H17N	unknown
+c1ccc2c(c1)CCCC21CCNC1	C13H17N	unknown
+CN1CC2c3ccccc3Oc3ccc(Cl)cc3C2C1	C17H16ClNO	unknown
+CN1CCc2ccccc2Cc2ccccc2CC1	C18H21N	unknown
+CN(C)C1Cc2ccccc2Sc2ccccc21	C16H17NS	unknown
+CN(C)C1Cc2ccccc2Nc2ccccc21	C16H18N2	unknown
+CN(C)CCCC1(c2ccc(F)cc2)OCc2cc(C#N)ccc21	C20H21FN2O	unknown
+Fc1ccc([C@@H]2CCNC[C@H]2COc2ccc3c(c2)OCO3)cc1	C19H20FNO3	unknown
+CN[C@H]1CC[C@@H](c2ccc(Cl)c(Cl)c2)c2ccccc21	C17H17Cl2N	unknown
+NC1CC12CC2c1ccccc1	C11H13N	unknown
+COc1ccc(C(=O)c2c(C)n(CCN3CCOCC3)c3ccccc23)cc1	C23H26N2O3	cannabinoid
+CCCCCn1cc(C(=O)c2cccc3ccccc23)c2ccccc21	C24H23NO	cannabinoid
+Cc1c(C(=O)c2cccc3ccccc23)c2cccc3c2n1[C@H](CN1CCOCC1)CO3	C27H26N2O3	cannabinoid
+CC1(C)C(C(=O)c2cn(CCCC(F)(F)F)c3ccccc23)C1(C)C	C20H24F3NO	cannabinoid
+COc1cccc2c(C(=O)N[C@@H]3C(C)(C)[C@@H]4CC[C@@]3(C)C4)cn(CCN3CCOCC3)c12	C26H37N3O3	cannabinoid
+CC(C)[C@H](NC(=O)c1nn(Cc2ccc(F)cc2)c2ccccc12)C(N)=O	C20H21FN4O2	cannabinoid
+CC(C)(NC(=O)c1cn(CCCCCF)c2ncccc12)c1ccccc1	C22H26FN3O	cannabinoid
+COc1cccc2c(C(=O)N3CCN(C)[C@@H](C)C3)cn(CC3CCCCC3)c12	C23H33N3O2	cannabinoid
+NC(=O)CN1CCN(Cc2nc(-c3cn(CC4CCOCC4)c4c(Cl)cccc34)no2)CC1	C23H29ClN6O3	cannabinoid
+Cc1ccc(C(=O)Oc2cccc3cccnc23)cc1S(=O)(=O)N1CCCCC1	C22H22N2O4S	cannabinoid
+O=S(=O)(CCCC(F)(F)F)Oc1cccc(Oc2cccc3c2C[C@H](CO)C3)c1	C20H21F3O5S	cannabinoid
+Cn1c(C(C)(C)C)c/c(=N\C(=O)c2cccc(C(F)(F)F)c2F)n1CC1CC1	C20H23F4N3O	cannabinoid
+CCCCCn1cc(C(=O)NC23CC4CC(CC(C4)C2)C3)c(=O)c2cc(C(C)C)ccc21	C28H38N2O2	cannabinoid
+O=C(O)CCc1csc(NC(=O)c2cc3c(n(CC4CCCCC4)c2=O)CCCCCC3)n1	C25H33N3O4S	cannabinoid
+CCCCCNc1c(OC)ccc2c1CN(CCc1ccc(O)cc1)C2=O	C22H28N2O3	cannabinoid
+CC(C)(O)CCn1c(=O)n(C(=O)N[C@H](C(N)=O)C(C)(C)C)c2ccccc21	C19H28N4O4	cannabinoid
+O=C(O)CCC(=O)OC1N=C(c2ccccc2Cl)c2cc(Br)ccc2NC1=O	C19H14BrClN2O5	aryldiazepine
+CC(C)(C)OC(=O)c1ncn2c1[C@@H]1CCCN1C(=O)c1c(Br)cccc1-2	C19H20BrN3O3	aryldiazepine
+N#CCCN1C(=O)C(O)N=C(c2ccccc2F)c2cc(Cl)ccc21	C18H13ClFN3O2	aryldiazepine
+CCc1cc2c(s1)N(C)C(=O)CN=C2c1ccccc1Cl	C16H15ClN2OS	aryldiazepine
+O=C1CN=C(c2ccccc2F)c2cc(Cl)ccc2N1CC1CC1	C19H16ClFN2O	aryldiazepine
+O=C1CN2CCOC2(c2ccccc2F)c2cc(Cl)ccc2N1CCO	C19H18ClFN2O3	aryldiazepine
+Cc1c2c(cn1C)NC(=O)CN=C2c1ccccc1	C15H15N3O	aryldiazepine
+Cc1nnc2n1-c1ccc(Br)cc1C(c1ccccc1)=NC2	C17H13BrN4	aryldiazepine
+Cc1nnc2n1-c1ccc([N+](=O)[O-])cc1C(c1ccccc1F)=NC2	C17H12FN5O2	aryldiazepine
+O=C(c1ccco1)N(c1ccccc1)C1CCN(CCc2ccccc2)CC1	C24H26N2O2	fentanyl
+COCC(=O)N(c1ccccc1)C1CCN(CCc2ccccc2)CC1	C22H28N2O2	fentanyl
+CC(C)C(=O)N(c1ccc(Cl)cc1)C1CCN(CCc2ccccc2)CC1	C23H29ClN2O	fentanyl
+O=C(C1CCCC1)N(c1ccccc1)C1CCN(CCc2ccccc2)CC1	C25H32N2O	fentanyl
+C=CC(=O)N(c1ccc(F)cc1)C1CCN(CCc2ccccc2)CC1	C22H25FN2O	fentanyl
+CCCC(=O)N(c1ccccc1)C1CCN(C(C)Cc2ccccc2)CC1	C24H32N2O	fentanyl
+CCN(CC)[C@@H]1CCCC[C@H]1N(C)C(=O)c1ccc(Cl)c(Cl)c1	C18H26Cl2N2O	unknown
+CN(C)[C@@H]1CCCC[C@H]1N(C)C(=O)Cc1ccc(Cl)cc1Cl	C17H24Cl2N2O	unknown
+CN(C)C1(CNC(=O)c2ccc(Cl)cc2)CCCCC1	C16H23ClN2O	unknown
+O=C(c1ccc2c(c1)OCO2)N(c1ccccc1)C1CCN(CCc2ccccc2)CC1	C27H28N2O3	fentanyl
+CNC(C)Cc1cc2c(cc1Br)OCO2	C11H14BrNO2	unknown
+COc1ccc2c(CCN(C(C)C)C(C)C)c[nH]c2c1	C17H26N2O	tryptamine
+CNC(C)C(=O)c1ccc(O)cc1	C10H13NO2	beta-ketone
+CC1COC(c2ccccc2)C(C)N1	C12H17NO	unknown
+FC1(F)Oc2ccc(CN3CCNCC3)cc2O1	C12H14F2N2O2	unknown
+O=[N+]([O-])c1ccc(CCN2CCCCC2=NS(=O)(=O)c2ccc(Cl)cc2)cc1	C19H20ClN3O4S	unknown
+Nc1ccc(CCN2CCCCC2=NS(=O)(=O)c2ccc(Cl)cc2)cc1	C19H22ClN3O2S	unknown
+Nc1ccc(CCN2CCCCC2=NS(=O)(=O)c2ccccc2)cc1	C19H23N3O2S	unknown
+CC(N)c1ccco1	C6H9NO	unknown
+CC(N)CCc1ccco1	C8H13NO	unknown
+NCCC1CCCO1	C6H13NO	unknown
+NCc1ccoc1	C5H7NO	unknown
+CC(N)c1cccs1	C6H9NS	unknown
+CNC(C)c1cccs1	C7H11NS	unknown
+NCc1cccs1	C5H7NS	unknown
+CNCc1cccs1	C6H9NS	unknown
+CCC(N)c1cccs1	C7H11NS	unknown
+CCC(NC)c1cccs1	C8H13NS	unknown
+NCCCc1cccs1	C7H11NS	unknown
+CNCCCc1cccs1	C8H13NS	unknown
+CN(C)CCC(=O)c1ccc[se]1	C9H13NOSe	unknown
+CC(CN(C)C)C(=O)c1ccc[se]1	C10H15NOSe	unknown
+CN(C)C(=O)c1ccc[te]1	C7H9NOTe	unknown
+NCc1cocn1	C4H6N2O	unknown
+NCc1nccs1	C4H6N2S	unknown
+NCc1cscn1	C4H6N2S	unknown
+CC(N)c1nccs1	C5H8N2S	unknown
+CC1OC(C[N+](C)(C)C)CC1O	C9H20NO2	unknown
+NC(C(=O)O)c1c[nH]c(=O)o1	C5H6N2O4	unknown
+CC(C)NCC(O)COc1cccc2ccccc12	C16H21NO2	unknown
+CC(C)NCC(O)COc1ccccc1C1CC1	C15H23NO2	unknown
+C=CCOc1ccccc1OCC(O)CNC(C)C	C15H23NO3	unknown
+C=CCc1ccccc1OCC(O)CNC(C)C	C15H23NO2	unknown
+CC(C)(C)NCC(O)COc1nsnc1N1CCOCC1	C13H24N4O3S	unknown
+CC(C)NCC(O)COc1cccc2[nH]ccc12	C14H20N2O2	unknown
+NC1CN(c2cccc(C(F)(F)F)c2)C1	C10H11F3N2	unknown
+FC(F)(F)c1cccc(NC2CNC2)c1	C10H11F3N2	unknown
+FC(F)(F)c1cccc(OC2CNC2)c1	C10H10F3NO	unknown
+FC(F)(F)c1ccnc(N2CCNCC2)c1	C10H12F3N3	unknown
+Brc1cc2c(s1)CCNCC2	C8H10BrNS	unknown
+CCNC(C)Cc1ccc(Cl)cc1	C11H16ClN	unknown
+CC(C)NCC(O)COc1ccc(CC(N)=O)cc1	C14H22N2O3	unknown
+CC(C)NCC(O)COc1ccc(CCOCC2CC2)cc1	C18H29NO3	unknown
+COCCc1ccc(OCC(O)CNC(C)C)cc1	C15H25NO3	unknown
+CC(C)NCC(O)c1ccc(Br)s1	C9H14BrNOS	unknown
+CC(C)(C)NCC(O)c1ccc(Br)s1	C10H16BrNOS	unknown
+CC(C)(C)NCC(O)c1ccc(Cl)s1	C10H16ClNOS	unknown
+OC(CN1CCCC1)c1ccc(Br)s1	C10H14BrNOS	unknown
+OC(CN1CCCCC1)c1ccc(Cl)s1	C11H16ClNOS	unknown
+CSc1ccc(CC(C)N)s1	C8H13NS2	unknown
+CC(N)Cc1sccc1Cl	C7H10ClNS	unknown
+CC(N)Cc1cc(Cl)cs1	C7H10ClNS	unknown
+CC(N)Cc1ccc(Cl)s1	C7H10ClNS	unknown
+CC(N)Cc1cc(Cl)c(Cl)s1	C7H9Cl2NS	unknown
+CC(N)Cc1ccc(I)s1	C7H10INS	unknown
+NCc1ccc[nH]1	C5H8N2	unknown
+CCCCn1cc(C(=O)C2C(C)(C)C2(C)C)c2ccccc21	C20H27NO	cannabinoid
+CN1CCCCC1Cn1cc(C(=O)C2C(C)(C)C2(C)C)c2ccccc21	C23H32N2O	cannabinoid
+CC1(C)C(C(=O)c2nn(CCCCCF)c3ccccc23)C1(C)C	C20H27FN2O	cannabinoid
+COCCn1cc(C(=O)C2C(C)(C)C2(C)C)c2ccccc21	C19H25NO2	cannabinoid
+CSCCCCn1cc(C(=O)C2C(C)(C)C2(C)C)c2ccccc21	C21H29NOS	cannabinoid
+CC1(C)C(C(=O)c2cn(Cc3ccncc3)c3ccccc23)C1(C)C	C22H24N2O	cannabinoid
+O=C(c1cccc2ccccc12)c1cn(CC2CCCCC2)c2ccccc12	C26H25NO	cannabinoid
+Cc1ccc(C(=O)c2cn(CC3CCCCC3)c3ccccc23)c2ccccc12	C27H27NO	cannabinoid
+CCc1ccc(C(=O)c2cn(CC3CCCCC3)c3ccccc23)c2ccccc12	C28H29NO	cannabinoid
+CCCCn1cc(C(=O)c2ccc(CC)c3ccccc23)c2ccccc21	C25H25NO	cannabinoid
+Cc1ccc2c(C(=O)c3cccc4ccccc34)cn(CCN3CCOCC3)c2c1	C26H26N2O2	cannabinoid
+CCCCCn1cc(C(=O)c2cccc3ccccc23)c2ccc(OC)cc21	C25H25NO2	cannabinoid
+COc1ccc(C(=O)c2cn(CC3CCCCC3)c3c(OC)cccc23)c2ccccc12	C28H29NO3	cannabinoid
+O=C(c1ccc(F)c2ccccc12)c1cn(CCCCCF)c2ccccc12	C24H21F2NO	cannabinoid
+O=C(c1ccc(Cl)c2ccccc12)c1cn(CCCCCF)c2ccccc12	C24H21ClFNO	cannabinoid
+Cc1ccc(C(=O)c2c(C)n(CCCCCF)c3ccccc23)c2ccccc12	C26H26FNO	cannabinoid
+Cc1ccc(C(=O)c2nn(CCCCCF)c3ccccc23)c2ccccc12	C24H23FN2O	cannabinoid
+CCc1ccc(C(=O)c2nn(CCCCCF)c3ccccc23)c2ccccc12	C25H25FN2O	cannabinoid
+CCCCCn1cc(C(=O)c2cccc(Cl)c2Cl)c2ccccc21	C20H19Cl2NO	cannabinoid
+O=C(c1cccc(Cl)c1Cl)c1cn(CCCCCF)c2ccccc12	C20H18Cl2FNO	cannabinoid
+CCCCCn1cc(C(=O)C2CCCC3CCCCC32)c2ccccc21	C24H33NO	cannabinoid
+CCCCCn1cc(C(=O)C2CCCCC2)c2ccccc21	C20H27NO	cannabinoid
+Cc1c(C(=O)c2ccccc2I)c2ccc([N+](=O)[O-])cc2n1CC1CCCCN1C	C23H24IN3O3	cannabinoid
+CN1CCCCC1Cn1cc(C(=O)c2cccc3ccccc23)c2ccc([N+](=O)[O-])cc21	C26H25N3O3	cannabinoid
+CN1CCCCC1Cn1cc(C(=O)c2ccc3ccc4cccc5ccc2c3c45)c2ccccc21	C32H28N2O	cannabinoid
+CCCCn1c(C)c(C(=O)c2ccccc2I)c2ccccc21	C20H20INO	cannabinoid
+CCCCCn1c(C)c(C(=O)c2ccccc2I)c2ccccc21	C21H22INO	cannabinoid
+CCCCCCn1c(C)c(C(=O)c2ccccc2I)c2ccccc21	C22H24INO	cannabinoid
+O=C(c1ccccc1I)c1cn(CCCCCF)c2cc([N+](=O)[O-])ccc12	C20H18FIN2O3	cannabinoid
+Cc1c(C(=O)c2ccccc2I)c2ccccc2n1CCCCCF	C21H21FINO	cannabinoid
+O=C(c1cccc2ccccc12)c1cn(CCCI)c2ccccc12	C22H18INO	cannabinoid
+O=C(c1cccc2ccccc12)c1cn(CCCCI)c2ccccc12	C23H20INO	cannabinoid
+O=C(c1cccc2ccccc12)c1cn(CCCCF)c2ccccc12	C23H20FNO	cannabinoid
+N#Cc1ccc(C(=O)c2cn(CC3CCCCC3)c3ccccc23)c2ccccc12	C27H24N2O	cannabinoid
+CN1CCOCC1Cn1cc(C(=O)c2ccccc2I)c2ccccc21	C21H21IN2O2	cannabinoid
+CN1CCOCC1Cn1cc(C(=O)c2cccc3ccccc23)c2ccccc21	C25H24N2O2	cannabinoid
+Cc1ccc(C(=O)c2cn(CCCCC#N)c3ccccc23)c2ccccc12	C25H22N2O	cannabinoid
+CCc1ccc(C(=O)c2cn(CCCCC#N)c3ccccc23)c2ccccc12	C26H24N2O	cannabinoid
+CCCCCn1nc(C(=O)c2ccc(C)c3ccccc23)c2ccccc21	C24H24N2O	cannabinoid
+CCCCCn1nc(C(=O)c2ccc(CC)c3ccccc23)c2ccccc21	C25H26N2O	cannabinoid
+CN1CCCCC1Cn1nc(C(=O)c2ccccc2I)c2ccccc21	C21H22IN3O	cannabinoid
+CN1CCCCC1Cn1nc(C(=O)c2cccc3ccccc23)c2ccccc21	C25H25N3O	cannabinoid
+O=C(c1cccc2ccccc12)c1cn(CC2CCOCC2)c2ccccc12	C25H23NO2	cannabinoid
+O=C(c1cccc2ccccc12)c1cn(CCCC(F)(F)F)c2ccccc12	C23H18F3NO	cannabinoid
+CCCCCn1c(C)c(C(=O)c2cccc3ccccc23)c2ccccc21	C25H25NO	cannabinoid
+CCCn1c(C)c(C(=O)c2cccc3ccccc23)c2ccccc21	C23H21NO	cannabinoid
+CCCCCCn1cc(C(=O)c2cccc3ccccc23)c2ccccc21	C25H25NO	cannabinoid
+CCCCCCCn1cc(C(=O)c2cccc3ccccc23)c2ccccc21	C26H27NO	cannabinoid
+C=CCCCn1cc(C(=O)c2cccc3ccccc23)c2ccccc21	C24H21NO	cannabinoid
+CCCCCCC(C)(C)c1ccc2c(c1)OC(C)(C)[C@@H]1CC=C(CO)C[C@@H]21	C25H38O2	cannabinoid
+CCCCn1cc(C(=O)c2cccc3ccccc23)c2ccccc21	C23H21NO	cannabinoid
+CCCCn1cc(C(=O)c2ccc(OC)c3ccccc23)c2ccccc21	C24H23NO2	cannabinoid
+CCCCCn1cc(C(=O)c2ccc(OC)c3ccccc23)c2ccccc21	C25H25NO2	cannabinoid
+CCCCCn1c(CC)c(C(=O)c2cccc3ccccc23)c2ccccc21	C26H27NO	cannabinoid
+CCCCCn1cc(C(=O)c2ccc(C)c3ccccc23)c2ccccc21	C25H25NO	cannabinoid
+CCCC(C)(C)c1ccc2c(c1)OC(C)(C)[C@@H]1CC=C(C)C[C@@H]21	C22H32O	cannabinoid
+CCCCCn1cc(C(=O)c2cccc3ccccc23)cc1-c1ccccc1	C26H25NO	cannabinoid
+CCCCCCn1cc(C(=O)c2cccc3ccccc23)cc1-c1ccccc1	C27H27NO	cannabinoid
+CCCCCn1c(C)c(C(=O)c2ccc(C)c3ccccc23)c2ccccc21	C26H27NO	cannabinoid
+CCCCCn1cc(C(=O)Cc2ccccc2)c2ccccc21	C21H23NO	cannabinoid
+CCCCCn1cc(Cc2cccc3ccccc23)c2ccccc21	C24H25N	cannabinoid
+CCCCCC1=C/C(=C\c2cccc3ccccc23)c2ccccc21	C25H24	cannabinoid
+CCCCCn1c(C)c(C(=O)c2ccc(CCC)c3ccccc23)c2ccccc21	C28H31NO	cannabinoid
+CCCCCn1cc(C(=O)c2ccc(CCC)c3ccccc23)c2ccccc21	C27H29NO	cannabinoid
+CCCCCn1cc(Cc2ccc(C)c3ccccc23)c2ccccc21	C25H27N	cannabinoid
+CCCCCn1cc(Cc2ccc(OC)c3ccccc23)c2ccccc21	C25H27NO	cannabinoid
+Cc1ccc(C(=O)c2cn(CCN3CCOCC3)c3ccccc23)c2ccccc12	C26H26N2O2	cannabinoid
+COc1ccc(C(=O)c2cn(CCN3CCOCC3)c3ccccc23)c2ccccc12	C26H26N2O3	cannabinoid
+O=C(c1cccc2ccccc12)c1cn(CCN2CCOCC2)c2ccccc12	C25H24N2O2	cannabinoid
+CCCCCn1cc(C(=O)Cc2ccc(OC)cc2)c2ccccc21	C22H25NO2	cannabinoid
+CCCCCn1cc(C(=O)Cc2ccccc2Cl)c2ccccc21	C21H22ClNO	cannabinoid
+CCCCCn1c(C)c(C(=O)Cc2ccccc2Cl)c2ccccc21	C22H24ClNO	cannabinoid
+CCCCCn1cc(C(=O)c2ccc(CC)c3ccccc23)c2ccccc21	C26H27NO	cannabinoid
+CCCCCn1c(C)c(C(=O)c2ccc(CC)c3ccccc23)c2ccccc21	C27H29NO	cannabinoid
+CCCCCC1=C/C(=C\c2ccc(C)c3ccccc23)c2ccccc21	C26H26	cannabinoid
+CCCCCn1cc(C(=O)c2ccc(CCCC)c3ccccc23)c2ccccc21	C28H31NO	cannabinoid
+CCCCCn1cc(C(=O)Cc2ccccc2Br)c2ccccc21	C21H22BrNO	cannabinoid
+CCCCCn1cc(C(=O)Cc2ccccc2OC)c2ccccc21	C22H25NO2	cannabinoid
+CCCCCn1cc(C(=O)Cc2ccccc2C)c2ccccc21	C22H25NO	cannabinoid
+CCCCCn1cc(C(=O)c2ccc(OCC)c3ccccc23)c2ccccc21	C26H27NO2	cannabinoid
+CCCCCn1cc(C(=O)Cc2cccc(OC)c2)c2ccccc21	C22H25NO2	cannabinoid
+CCCCCn1cc(C(=O)c2cccc3ccccc23)cc1-c1ccccc1F	C26H24FNO	cannabinoid
+CCCCCn1cc(C(=O)c2cccc3ccccc23)cc1-c1cccc2ccccc12	C30H27NO	cannabinoid
+CCCCCn1cc(C(=O)c2cccc3ccccc23)cc1-c1ccccc1C	C27H27NO	cannabinoid
+CCCCCn1cc(C(=O)c2ccc3ccccc3c2)c2ccccc21	C24H23NO	cannabinoid
+CCCCCn1cc(C(=O)c2ccc(Br)c3ccccc23)c2ccccc21	C24H22BrNO	cannabinoid
+CCCCCn1cc(C(=O)c2ccc(Cl)c3ccccc23)c2ccccc21	C24H22ClNO	cannabinoid
+CCCCCn1cc(C(=O)c2ccc(F)c3ccccc23)c2ccccc21	C24H22FNO	cannabinoid
+CCCCCn1cc(C(=O)c2ccc(I)c3ccccc23)c2ccccc21	C24H22INO	cannabinoid
+CCCCCn1cc(C(=O)c2cccc3cccc(Br)c23)c2ccccc21	C24H22BrNO	cannabinoid
+O=C(c1cccc2ccccc12)c1cn(CCCCCCF)c2ccccc12	C25H24FNO	cannabinoid
+CCCCCn1c(C)c(C(=O)c2ccc(OC)c3ccccc23)c2ccccc21	C26H27NO2	cannabinoid
+CCCCCn1ccc(C(=O)c2cccc3ccccc23)c1	C20H21NO	cannabinoid
+CCCCn1cc(C(=O)c2ccc(C)c3ccccc23)c2ccccc21	C24H23NO	cannabinoid
+N#CCCCCn1cc(C(=O)c2cccc3ccccc23)c2ccc([N+](=O)[O-])cc21	C24H19N3O3	cannabinoid
+O=C(c1cccc2ccccc12)c1cn(CCCCCO)c2ccccc12	C24H23NO2	cannabinoid
+O=C(c1cccc2ccccc12)c1cn(CCCCCI)c2ccccc12	C24H22INO	cannabinoid
+O=C(c1cccc2ccccc12)c1cn(CCCCCF)c2cc(I)ccc12	C24H21FINO	cannabinoid
+O=C(c1ccc([N+](=O)[O-])c2ccccc12)c1cn(CCCCI)c2ccccc12	C23H19IN2O3	cannabinoid
+Cc1ccccc1C(=O)c1cn(CCCCCF)c2ccccc12	C21H22FNO	cannabinoid
+CCc1ccccc1C(=O)c1cn(CCCCCF)c2ccccc12	C22H24FNO	cannabinoid
+O=C(c1ccccc1I)c1nn(CCCCCF)c2ccccc12	C19H18FIN2O	cannabinoid
+CCCCCn1cc(C(=O)c2ccccc2)c2ccccc21	C20H21NO	cannabinoid
+CCCCCn1cc(C(=O)c2ccc(C)cc2)c2ccccc21	C21H23NO	cannabinoid
+CCCCn1cc(C(=O)c2ccccc2OC)c2ccccc21	C20H21NO2	cannabinoid
+CCCCCn1cc(C(=O)c2ccc(C)c(C)c2)c2ccccc21	C22H25NO	cannabinoid
+CCCCCn1cc(C(=O)c2cccc3ccccc23)c2cc(F)ccc21	C24H22FNO	cannabinoid
+CCCCCn1cc(C(=O)c2cccc3ccccc23)c2ccc(F)cc21	C24H22FNO	cannabinoid
+CCCCCn1cc(C(=O)c2cccc3ccccc23)c2cccc(F)c21	C24H22FNO	cannabinoid
+O=C(c1cccc2ccccc12)c1cn(CCCCCF)c2cccc(F)c12	C24H21F2NO	cannabinoid
+CCCCCn1cc(C(=O)c2ccc(CCC)c3ccccc23)c2c(F)cccc21	C27H28FNO	cannabinoid
+CCCCCn1cc(C(=O)c2cccc3ccccc23)c2cccnc21	C23H22N2O	cannabinoid
+CCCCCn1cc(C(=O)c2cccc3ccccc23)c2ccncc21	C23H22N2O	cannabinoid
+CCCCCn1cc(C(=O)c2cccc3ccccc23)c2cnccc21	C23H22N2O	cannabinoid
+O=C(c1cn(CCN2CCOCC2)c2ccccc12)C1CCCCCC1	C22H30N2O2	cannabinoid
+O=C(c1cn(CC2CCOCC2)c2ccccc12)C1CCCC1	C20H25NO2	cannabinoid
+O=C(c1cn(CC2CCOCC2)c2ccccc12)C1CC12CCCCC2	C23H29NO2	cannabinoid
+O=C(c1cn(CC2CCOCC2)c2ccccc12)C12CC3CC(CC1C3)C2	C24H29NO2	cannabinoid
+Cc1ccc(C(=O)c2cn(CC3CCCCN3C)c3ccccc23)c2ccccc12	C27H28N2O	cannabinoid
+CN1CCCCC1Cn1cc(C(=O)c2ccc(F)c3ccccc23)c2ccccc21	C26H25FN2O	cannabinoid
+CN1CCCCC1Cn1cc(C(=O)c2ccc(Br)c3ccccc23)c2ccccc21	C26H25BrN2O	cannabinoid
+COc1ccc(C(=O)c2cn(CC3CCCCN3C)c3ccccc23)c2ccccc12	C27H28N2O2	cannabinoid
+CN1CCCCC1Cn1cc(C(=O)c2ccc(O)c3ccccc23)c2ccccc21	C26H26N2O2	cannabinoid
+CN1CCCCC1Cn1cc(C(=O)c2ccc(C#N)c3ccccc23)c2ccccc21	C27H25N3O	cannabinoid
+CN1CCCCC1Cn1cc(C(=O)c2ccc(CCO)c3ccccc23)c2ccccc21	C28H30N2O2	cannabinoid
+CN1CCCCC1Cn1cc(C(=O)c2cccc3cc(O)ccc23)c2ccccc21	C26H26N2O2	cannabinoid
+CN1CCCCC1Cn1cc(C(=O)N2CCCC3CCCCC32)c2ccccc21	C25H35N3O	cannabinoid
+CCCCCn1cc(C(=O)C2=CC=C(C(=O)OC)C3C=CC=CC23)c2ccccc21	C26H27NO3	cannabinoid
+CCCCCn1cc(C(=O)c2ccc(C(=O)CC)c3ccccc23)c2ccccc21	C27H27NO2	cannabinoid
+CCCCCn1cc(C(=O)c2cccc3ccccc23)c2c(F)cccc21	C24H22FNO	cannabinoid
+CCc1ccc(C(=O)c2cn(CCN3CCOCC3)c3ccccc23)c2ccccc12	C27H28N2O2	cannabinoid
+CCc1ccc(C(=O)c2cn(CC3CCCCN3C)c3ccccc23)c2ccccc12	C28H30N2O	cannabinoid
+O=C(c1cn(CC2CCCCC2)c2ccccc12)C12CC3CC(CC(C3)C1)C2	C26H33NO	cannabinoid
+O=C(c1cn(CCN2CCOCC2)c2ccccc12)C12CC3CC(CC(C3)C1)C2	C25H32N2O2	cannabinoid
+O=C(c1cn(CC2CCOCC2)c2ccccc12)C12CC3CC(CC(C3)C1)C2	C25H31NO2	cannabinoid
+O=C(c1ccc(F)c2ccccc12)c1cn(CC2CCCCC2)c2ccccc12	C26H24FNO	cannabinoid
+O=C(c1cccc2ccccc12)c1cn(CCN2CCCCC2)c2ccccc12	C26H26N2O	cannabinoid
+O=C1/C(=N\NC(=O)C23CC4CC(CC(C4)C2)C3)c2ccccc2N1CCCCCF	C24H30FN3O2	cannabinoid
+CC1(C)C(C(=O)N/N=C2\C(=O)N(CCCCCF)c3ccccc32)C1(C)C	C21H28FN3O2	cannabinoid
+CCCCCc1cn(C(=O)c2cccc3ccccc23)c2ccccc12	C24H23NO	cannabinoid
+Cc1c(C(=O)c2cccc3ccccc23)c2ccccc2n1CCN1CCOCC1	C26H26N2O2	cannabinoid
+Cc1c(C(=O)c2cccc3ccccc23)c2ccccc2n1CCN1CCCCC1	C27H28N2O	cannabinoid
+O=C(c1ccccc1Cl)c1cn(CCCCCF)c2ccccc12	C20H19ClFNO	cannabinoid
+C=CCCCn1cc(C(=O)c2ccccc2I)c2ccccc21	C20H18INO	cannabinoid
+CCCCCn1cc(C(=O)c2cccc(OC)c2)c2ccccc21	C21H23NO2	cannabinoid
+COc1ccccc1C(=O)c1cn(CCCCCF)c2ccccc12	C21H22FNO2	cannabinoid
+O=C(c1cccc2ccccc12)c1cn(CCCCCCl)c2ccccc12	C24H22ClNO	cannabinoid
+O=C(c1cccc2ccccc12)c1cn(CCCCCBr)c2ccccc12	C24H22BrNO	cannabinoid
+Cc1c(C(=O)c2cccc3ccccc23)c2ccccc2n1Cc1ccccc1F	C27H20FNO	cannabinoid
+Cc1ccc(C(=O)c2cn(CCCCCI)c3ccccc23)c2ccccc12	C25H24INO	cannabinoid
+Cc1ccc(C(=O)c2cn(CCCCCCl)c3ccccc23)c2ccccc12	C25H24ClNO	cannabinoid
+C=CCCCn1c(C)c(C(=O)c2ccc(C)c3ccccc23)c2ccccc21	C26H25NO	cannabinoid
+CCCCCCCCn1cc(C(=O)c2cccc3ccccc23)c2ccccc21	C27H29NO	cannabinoid
+CCCCCCCCCCn1cc(C(=O)c2cccc3ccccc23)c2ccccc21	C29H33NO	cannabinoid
+O=C(C1=CC=CC2C=CC=CC12)c1cn(C2CC2)c2ccccc12	C22H19NO	cannabinoid
+O=C(c1cccc2ccccc12)c1cn(CC2CC2)c2ccccc12	C23H19NO	cannabinoid
+O=C(c1cccc2ccccc12)c1cn(C2CCCC2)c2ccccc12	C24H21NO	cannabinoid
+CCCC(C)n1cc(C(=O)c2cccc3ccccc23)c2ccccc21	C24H23NO	cannabinoid
+CCC(CC)n1cc(C(=O)c2cccc3ccccc23)c2ccccc21	C24H23NO	cannabinoid
+CCC(C)Cn1cc(C(=O)c2cccc3ccccc23)c2ccccc21	C24H23NO	cannabinoid
+CC(C)CCn1cc(C(=O)c2cccc3ccccc23)c2ccccc21	C24H23NO	cannabinoid
+O=C(c1cccc2ccccc12)c1cn(Cc2ccccc2)c2ccccc12	C26H19NO	cannabinoid
+C=CCn1cc(C(=O)c2cccc3ccccc23)c2ccccc21	C22H17NO	cannabinoid
+O=C(c1cccc2ccccc12)c1cn2c3c(cccc13)OC[C@H]2CN1CCOCC1	C26H24N2O3	cannabinoid
+Cc1c(C(=O)c2ccc(Br)c3ccccc23)c2cccc3c2n1[C@H](CN1CCOCC1)CO3	C27H25BrN2O3	cannabinoid
+COc1ccc(C(=O)c2c(C)n3c4c(cccc24)OC[C@H]3CN2CCOCC2)cc1	C24H26N2O4	cannabinoid
+Cc1c(C(=O)c2ccccc2F)c2cccc3c2n1[C@H](CN1CCOCC1)CO3	C23H23FN2O3	cannabinoid
+Cc1c(C(=O)c2ccc3cccnc3c2)c2cccc3c2n1[C@H](CN1CCOCC1)CO3	C26H25N3O3	cannabinoid
+COC(=O)[C@@H](NC(=O)c1c(C)n2c3c(cccc13)OC[C@H]2CN1CCOCC1)C(C)(C)C	C24H33N3O5	cannabinoid
+Cc1c(C(=O)N[C@@H]2C(C)(C)[C@@H]3CC[C@@]2(C)C3)c2cccc3c2n1[C@H](CN1CCOCC1)CO3	C27H37N3O3	cannabinoid
+CC1(C)[C@@H]2CC[C@@](C)(C2)[C@@H]1NC(=O)c1nn2c3c(cccc13)OC[C@H]2CN1CCOCC1	C25H34N4O3	cannabinoid
+O=C(c1cn2c3c(cccc13)OC[C@H]2C1CCCCC1)N1CCN2CCCC[C@H]2C1	C25H33N3O2	cannabinoid
+CCN1CCN(C(=O)c2cn3c4c(cccc24)CC[C@H]3C2CCCC2)CC1	C23H31N3O	cannabinoid
+COCCN1[C@H](C)CN(C(=O)c2cn3c4c(cccc24)OC[C@H]3C2CCCCC2)C[C@@H]1C	C26H37N3O3	cannabinoid
+CCN(CC)Cc1nc(-c2cn3c4c(cccc24)OC[C@H]3C2CCCCC2)ns1	C23H30N4OS	cannabinoid
+C[C@H]1CN(C(=O)c2cn3c4c(cccc24)OC[C@H]3C2CCCCC2)CCN1C	C23H31N3O2	cannabinoid
+CCN1[C@H](C)CN(C(=O)c2cn3c4c(cccc24)OC[C@H]3C2CCCCC2)C[C@@H]1C	C25H35N3O2	cannabinoid
+Cc1c(C(=O)c2cccc3ccccc23)c2cccc3c2n1CC(CN1CCOCC1)O3	C27H26N2O3	cannabinoid
+CC[C@@H]1COc2cccc3c(=O)c(C(=O)NC45CC6CC(CC(C6)C4)C5)cn1c23	C24H28N2O3	cannabinoid
+CCCCCN1C(=O)/C(=N\NC(=O)c2ccccc2)c2ccccc21	C20H21N3O2	cannabinoid
+O=C(N/N=C1\C(=O)N(CC2CCCCC2)c2ccccc21)c1ccccc1	C22H23N3O2	cannabinoid
+O=C1/C(=N\c2cccc3ccccc23)c2cc(Cl)ccc2N1CCN1CCOCC1	C24H22ClN3O2	cannabinoid
+Cc1ccc(NCc2cn(CCN3CCOCC3)c3ccccc23)cc1	C22H27N3O	cannabinoid
+COc1ccc(C(=O)c2c3n(c4ccccc24)C(CN2CCOCC2)CC3)cc1	C24H26N2O3	cannabinoid
+COc1cccc2c3c(=O)n([C@@H]4C(C)(C)[C@@H]5CC[C@@]4(C)C5)ccc3n(CCN3CCOCC3)c12	C28H37N3O3	cannabinoid
+CCCCCn1c2ccccc2c2c(=O)n(C(C)(C)c3ccccc3)ccc21	C25H28N2O	cannabinoid
+CCCCCn1cc(C(=O)NC23CC4CC(CC(C4)C2)C3)c(=O)c2ccccc21	C25H32N2O2	cannabinoid
+CCCCCOc1cccc2c(=O)c(C(=O)NC34CC5CC(CC(C5)C3)C4)c[nH]c12	C25H32N2O3	cannabinoid
+CCCCCn1c(=O)c(C(=O)NC23CC4CC(CC(C4)C2)C3)cc2ccccc21	C25H32N2O2	cannabinoid
+CCCCCn1cc(C(=O)NC23CC4CC(CC(C4)C2)C3)c(=O)c2ccc(Sc3ccccc3)cc21	C31H36N2O2S	cannabinoid
+CCCCCn1cc(C(=O)N[C@@H]2C(C)(C)[C@@H]3CC[C@@]2(C)C3)c(=O)c2cc(Br)ccc21	C25H33BrN2O2	cannabinoid
+CCCCCn1cc(C(=O)N[C@@H]2C(C)(C)[C@@H]3CC[C@@]2(C)C3)c(=O)c2ccc(F)cc21	C25H33FN2O2	cannabinoid
+CCCCCn1cc(C(=O)N[C@@H]2C(C)(C)[C@@H]3CC[C@@]2(C)C3)c(=O)c2ccc(Sc3ccccc3)cc21	C31H38N2O2S	cannabinoid
+CCCCCn1cc(C(=O)NCc2ccc(Cl)c(Cl)c2)c(=O)c2ccc(-c3ccccc3)cc21	C28H26Cl2N2O2	cannabinoid
+CCCCCn1cc(C(=O)N[C@H]2CCCc3ccccc32)c(=O)c2ccccc21	C25H28N2O2	cannabinoid
+O=C(NC1CCCCCC1)c1cn(Cc2ccccc2)c2ccccc2c1=O	C24H26N2O2	cannabinoid
+O=C(NC1CCCCCC1)c1cn(CCN2CCOCC2)c2ccccc2c1=O	C23H31N3O3	cannabinoid
+CC(C)(NC(=O)c1cn(CCCCCF)c2ccccc2c1=O)c1ccccc1	C24H27FN2O2	cannabinoid
+COc1ccc2c(=O)c(C(=O)NC3CCCCC3)cn(Cc3ccccc3)c2c1	C24H26N2O3	cannabinoid
+Cc1ccc2c(=O)c(C(=O)NC3CCCCC3)cn(Cc3ccc(F)cc3)c2n1	C23H24FN3O2	cannabinoid
+Cc1ccc2c(=O)c(C(=O)NC3CCC(C)CC3)cn(Cc3ccccc3F)c2n1	C24H26FN3O2	cannabinoid
+Cc1ccc2c(=O)c(C(=O)NC3CCCCCC3)cn(Cc3ccc(F)cc3)c2n1	C24H26FN3O2	cannabinoid
+O=C(NC1CCCCCC1)c1cc2cccnc2n(Cc2ccc(F)cc2)c1=O	C23H24FN3O2	cannabinoid
+O=C(NC1CCCCCC1)c1cc2cccnc2n(CCN2CCOCC2)c1=O	C22H30N4O3	cannabinoid
+Cc1cc(C(=O)NC(C)(C)c2ccccc2)c(=O)n(CC2CCCCC2)c1C	C24H32N2O2	cannabinoid
+CCCCn1c2c(cc(C(=O)NC(C)(C)c3ccccc3)c1=O)C1CCC2C1	C24H30N2O2	cannabinoid
+CCCCn1c(-c2ccccc2)c(C)cc(C(=O)NC(C)(C)c2ccccc2)c1=O	C26H30N2O2	cannabinoid
+CCCCn1c2c(cc(C(=O)NC(C)(C)c3ccccc3)c1=O)COCC2	C22H28N2O3	cannabinoid
+C[C@@H](NC(=O)c1cc2c(n(Cc3ccncc3)c1=O)CCCCCC2)c1ccccc1	C26H29N3O2	cannabinoid
+CCCCCn1c(C)c(C(=O)c2ccc(N(C)C)c3ccccc23)c2ccccc21	C27H30N2O	cannabinoid
+COc1ccc(C(=O)c2cn(CC3CCCCN3C)c3ccccc23)cc1	C23H26N2O2	cannabinoid
+CN1CCCC1Cn1cc(C(=O)c2ccccc2F)c2ccccc21	C21H21FN2O	cannabinoid
+O=C(c1cccc2ccccc12)c1c(Cl)n(CCN2CCOCC2)c2ccccc12	C25H23ClN2O2	cannabinoid
+Cc1c(C(=O)c2ccc3cccnc3c2)c2ccccc2n1CCN1CCOCC1	C25H25N3O2	cannabinoid
+O=C(c1cn(CCN2CCOCC2)c2ccccc12)c1cccc2ccoc12	C23H22N2O3	cannabinoid
+COc1cccc2c(C(=O)c3ccc(Br)c4ccccc34)c(C)n(CCN3CCOCC3)c12	C27H27BrN2O3	cannabinoid
+CCc1cccc2c(C(=O)c3cccc(Cl)c3Cl)cn(CCCSC)c12	C21H21Cl2NOS	cannabinoid
+CCCCCn1cc(C(=O)c2cccc(-c3ccccc3)c2)c2ccccc21	C26H25NO	cannabinoid
+CCCCCn1cc(C(=O)c2ccccc2-c2ccccc2)c2ccccc21	C26H25NO	cannabinoid
+O=C(c1cccnc1)c1cn(CCCCCF)c2ccccc12	C19H19FN2O	cannabinoid
+CCCCCn1cc(C(=O)c2cc(C(C)(C)C)no2)c2ccccc21	C21H26N2O2	cannabinoid
+CN(C)[C@H]1CCCC[C@@H]1NC(=O)c1ccc(Br)cc1	C15H21BrN2O	unknown
+CN(C)[C@H]1CCCC[C@@H]1NC(=O)c1ccc(Cl)c(Cl)c1	C15H20Cl2N2O	unknown
+CN(C)[C@H]1CCCC[C@@H]1N(C)C(=O)c1ccc(O)cc1	C16H24N2O2	unknown
+CN(C(=O)c1ccc(Br)c(Br)c1)[C@H]1CCCCC12CCCN2C	C18H24Br2N2O	unknown
+CN(C)[C@H]1CCCC[C@@H]1N(C)C(=O)c1ccc(Cl)cc1	C16H23ClN2O	unknown
+COc1cc(C(=O)CN)c(OC)cc1I	C10H12INO3	beta-ketone
+CC(Cc1ccccc1)N1CCCC1	C13H19N	unknown
+COc1cc(-c2cnc(-c3cc(OC)c(Br)cc3OC)cn2)c(OC)cc1Br	C20H18Br2N2O4	unknown
+COc1cc(-c2cnco2)c(OC)cc1Br	C11H10BrNO3	unknown
+COc1cc(-c2cnco2)c(OC)cc1I	C11H10INO3	unknown
+COc1cc(C(C)=O)c(OC)cc1Br	C10H11BrO3	unknown
+COc1cc(C(C)=O)c(OC)cc1I	C10H11IO3	unknown
+CCCCCOc1c(OC)ccc2cc(C(=O)NCc3ccc(F)cc3)c(=O)[nH]c12	C23H25FN2O4	cannabinoid
+CCCCCOc1c(OC)ccc2c(=O)n(C(=O)NCCc3ccncc3)c(=O)[nH]c12	C22H26N4O5	cannabinoid
+CCCCCOc1cc(C(=O)NCCc2ccc(O)cc2)cc2ccccc12	C24H27NO3	cannabinoid
+CCCCCOc1cc(/C=C/C(=O)NCc2ccc(O)cc2)ccc1OC	C22H27NO4	cannabinoid
+CCCn1c(C(=O)c2c(C)n(CCN3CCOCC3)c3sccc23)cc2ccccc21	C25H29N3O2S	cannabinoid
+CCn1c(C(=O)c2cn(CC3CCOCC3)c3ccccc23)cc2ccsc21	C23H24N2O2S	cannabinoid
+CCCn1cc(C(=O)c2cc3ccsc3n2CC)c2cccnc21	C19H19N3OS	cannabinoid
+CCCn1c(C(=O)c2c(C)n(CCC)c3sccc23)cc2ccsc21	C20H22N2OS2	cannabinoid
+CCN(CCCC(=O)NC1CC1)C(=O)c1ccc2c(c1)c1c(n2C)CCC(C2CCOCC2)C1	C28H39N3O3	cannabinoid
+COc1ccc2c(OCCN3CCOCC3)c(C(=O)NCc3ccccc3)oc2c1	C23H26N2O5	cannabinoid
+CCOc1ccc(Cc2nc3cc(C(=O)N(CC)CC)ccc3n2CC2CCCCC2)cc1	C28H37N3O2	cannabinoid
+CCC(C)(C)c1nc2cc(C(=O)N3C[C@@H](C)O[C@@H](C)C3)ccc2n1CC1CCCCC1	C26H39N3O2	cannabinoid
+CC(C)[C@H](NC(=O)c1cc(-c2ccc(F)cc2)n(CCCCCF)n1)C(N)=O	C20H26F2N4O2	cannabinoid
+CC(C)[C@H](NC(=O)c1cc(-c2ccc(F)cc2)n(CC2CCCCC2)n1)C(N)=O	C22H29FN4O2	cannabinoid
+CCCCCn1nc(C(=O)NC23CC4CC(CC(C4)C2)C3)c(C)c1-c1ccccc1	C26H35N3O	cannabinoid
+Cc1c(C(=O)NC23CC4CC(CC(C4)C2)C3)nn(CCCCCF)c1-c1ccccc1	C26H34FN3O	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1cc(-c2ccccc2F)n(CC2CCOCC2)n1)C(=O)OC1CC1	C25H32FN3O4	cannabinoid
+COCCN1[C@H](C)CN(C(=O)c2cc(-c3ccccc3F)n(CC3CCOCC3)n2)C[C@@H]1C	C25H35FN4O3	cannabinoid
+CCCCCNC(=O)c1nn(-c2ccc(Cl)cc2Cl)c(-c2ccc(Cl)cc2)c1C	C22H22Cl3N3O	cannabinoid
+CC(C)(NC(=O)c1nn(-c2ccc(F)cc2F)c2c1C1CCC2C1)c1ccccc1	C24H23F2N3O	cannabinoid
+CCCCCc1nc(C(=O)NC23CC4CC(CC(C4)C2)C3)sc1-c1ccccc1	C25H32N2OS	cannabinoid
+CCCCC1=NN(C(=O)NC(C)(C)c2ccccc2)C(C)(C)C1c1ccccc1	C25H33N3O	cannabinoid
+CCCCCN1N=C(C(=O)N[C@H]2C[C@H]3CC[C@]2(C)C3(C)C)CC1c1ccccc1F	C25H36FN3O	cannabinoid
+CCCCCN1N=C(C(=O)NC(C)(C)c2ccc(F)cc2)CC1c1ccccc1	C24H30FN3O	cannabinoid
+CCCCCn1nc(C(=O)Oc2cccc3cccnc23)c2ccccc21	C22H21N3O2	cannabinoid
+CCCCCn1cc(C(=O)Nc2cccc3cccnc23)c2ccccc21	C23H23N3O	cannabinoid
+O=C(Oc1cccc2cccnc12)c1nn(CCCCCF)c2ccccc12	C22H20FN3O2	cannabinoid
+O=C(Nc1cccc2cccnc12)c1cn(CCCCCF)c2ccccc12	C23H22FN3O	cannabinoid
+CCCCCn1cc(C(=O)Oc2cccc3ccccc23)c2ccccc21	C24H23NO2	cannabinoid
+Cc1c(C(=O)Oc2cccc3cccnc23)c2ccccc2n1CCCCCF	C24H23FN2O2	cannabinoid
+O=C(Oc1cccc2cccnc12)c1nn(Cc2ccc(F)cc2)c2ccccc12	C24H16FN3O2	cannabinoid
+O=C(Oc1cccc2cccnc12)c1cn(CCCCCF)c2ncccc12	C22H20FN3O2	cannabinoid
+O=C(Oc1cccc2cccnc12)c1cn(Cc2ccccc2)c2ccccc12	C25H18N2O2	cannabinoid
+O=C(Oc1cccc2cccnc12)c1cn(-c2ccccc2F)c2ccccc12	C24H15FN2O2	cannabinoid
+O=C(Oc1cccc2cccnc12)c1cn(CC2CCOCC2)c2ccccc12	C24H22N2O3	cannabinoid
+O=C(Oc1cccc2cccnc12)c1cn(CCCCF)c2ccccc12	C22H19FN2O2	cannabinoid
+Cc1ccc(C(=O)Oc2cccc3cccnc23)cc1S(=O)(=O)N1CCOCC1	C21H20N2O5S	cannabinoid
+Cc1ccc(C(=O)Oc2cccc3cccnc23)cc1S(=O)(=O)N1CCC(F)(F)CC1	C22H20F2N2O4S	cannabinoid
+O=C(Oc1cccc2cccnc12)c1cccc(S(=O)(=O)N2CCCCC2)c1	C21H20N2O4S	cannabinoid
+Cc1ccc(C(=O)Oc2ccccc2Br)cc1S(=O)(=O)N1CCCCC1	C19H20BrNO4S	cannabinoid
+Cc1ccc(C(=O)Nc2cccc3cccnc23)cc1S(=O)(=O)N1CCCCC1	C22H23N3O3S	cannabinoid
+Cc1ccc(C(=O)Nc2nccc3ccccc23)cc1S(=O)(=O)N1CCCCC1	C22H23N3O3S	cannabinoid
+Cc1ccc(C(=O)N[C@@H](C)C2CCCCC2)cc1S(=O)(=O)N1CCCCC1	C21H32N2O3S	cannabinoid
+Cc1ccc(C(=O)Oc2cccc3cccnc23)cc1S(=O)(=O)NC(C)C	C20H20N2O4S	cannabinoid
+CC1(C)[C@@H]2CC[C@@](C)(C2)[C@@H]1NC(=O)c1ccc(Br)c(S(=O)(=O)N2CCCCC2)c1	C22H31BrN2O3S	cannabinoid
+Cc1ccc(C(=O)NC2C3CC4CC(C3)CC2C4)cc1S(=O)(=O)N1CCOCC1	C22H30N2O4S	cannabinoid
+CCCCCn1c2ccccc2c2cc(C(=O)N3CCCCC3)ccc21	C23H28N2O	cannabinoid
+COc1ccc(/C=C2\C(C)=C(CCN3CCOCC3)c3ccccc32)cc1	C24H27NO2	cannabinoid
+COc1ccc(/C=C2\C=C(CCN3CCOCC3)c3ccccc32)cc1OC	C24H27NO3	cannabinoid
+C1=C(CCN2CCOCC2)c2ccccc2/C1=C/c1cccc2ccccc12	C26H25NO	cannabinoid
+CC1=C(CCN2CCOCC2)c2ccccc2/C1=C/c1cccc2ccccc12	C27H27NO	cannabinoid
+COc1ccc(/C=C2\C=C(CCN3CCOCC3)c3ccccc32)c2ccccc12	C27H27NO2	cannabinoid
+C1=C(CCN2CCOCC2)c2ccccc2/C1=C/c1cccc2[nH]ccc12	C24H24N2O	cannabinoid
+CCc1ccc(/C=C2\C=C(CCN3CCOCC3)c3ccccc32)c2ccccc12	C28H29NO	cannabinoid
+CCCc1ccc(/C=C2\C=C(CCN3CCOCC3)c3ccccc32)c2ccccc12	C29H31NO	cannabinoid
+Ic1ccccc1/C=C1\C=C(CCN2CCOCC2)c2ccccc21	C22H22INO	cannabinoid
+C1=C(CCN2CCOCC2)c2ccccc2/C1=C/c1cccc2ccc3ccccc3c12	C30H27NO	cannabinoid
+C1=C(CCN2CCOCC2)c2ccccc2/C1=C/c1ccc2c3c(cccc13)CC2	C28H27NO	cannabinoid
+O=C(NCC1CCCCC1)c1cccc(S(=O)(=O)N2CCCCC2)c1	C19H28N2O3S	cannabinoid
+CCCCS(=O)(=O)Nc1cccc(Oc2cccc3ccccc23)c1	C20H21NO3S	cannabinoid
+O=S(=O)(Cc1ccccc1)Nc1cccc(Oc2cccc3ccccc23)c1	C23H19NO3S	cannabinoid
+CCCCS(=O)(=O)Nc1ccc(Oc2cccc3cc(CO)ccc23)cc1	C21H23NO4S	cannabinoid
+CCCCS(=O)(=O)Nc1ccc(S(=O)(=O)c2cccc3ccccc23)cc1	C20H21NO4S2	cannabinoid
+CCCCP(=O)(Nc1ccc(Oc2cccc3ccccc23)cc1)OC	C21H24NO3P	cannabinoid
+CCCCS(=O)(=O)Nc1ccc(Oc2cccc3cccnc23)nc1	C18H19N3O3S	cannabinoid
+CCCN1CCc2c(cccc2Oc2ccc(OS(=O)(=O)CCCC(F)(F)F)cc2)C1	C22H26F3NO4S	cannabinoid
+O=S(=O)(CCCC(F)(F)F)Nc1cccc(Oc2cccc3c2C[C@H](CO)C3)c1	C20H22F3NO4S	cannabinoid
+O=S(=O)(CCCC(F)(F)F)Oc1cccc(Oc2cccc3cc(CO)oc23)c1	C19H17F3O6S	cannabinoid
+CCc1coc(-c2cccc(OS(=O)(=O)CCCC(F)(F)F)c2)n1	C15H16F3NO4S	cannabinoid
+N#Cc1c(Oc2cccc(OS(=O)(=O)CCCC(F)(F)F)c2)cccc1C(F)(F)F	C18H13F6NO4S	cannabinoid
+O=C(NCC1CCCCC1)c1cc(Cl)ccc1NC(=O)c1cccc2ccccc12	C25H25ClN2O2	cannabinoid
+O=C(NCC1CCCCC1)c1ncccc1NC(=O)c1cccc2ccccc12	C24H25N3O2	cannabinoid
+O=C(NCC1CCCCC1)c1nccnc1NC(=O)c1cccc2ccccc12	C23H24N4O2	cannabinoid
+O=C(NCC1CCC1)c1ncccc1NC(=O)c1cccc2ccccc12	C22H21N3O2	cannabinoid
+O=C(NCC1CCC1)c1ncccc1NC(=O)c1ccnc2ccccc12	C21H20N4O2	cannabinoid
+COCc1ccc(C(=O)Nc2cccnc2C(=O)NCC2CCC2)c2ccccc12	C24H25N3O3	cannabinoid
+O=C(NCC1CCC1)c1ncccc1NC(=O)c1ccc(Cn2ccnn2)c2ccccc12	C25H24N6O2	cannabinoid
+COc1ccc(NC(=O)c2ccc(CS(C)=O)c3ccccc23)c(C(=O)NCC2CCOCC2)n1	C26H29N3O5S	cannabinoid
+O=C(NCC1CCOCC1)c1nc(OS(=O)(=O)CCC(F)(F)F)ccc1NC(=O)c1ccc(Cn2ccnn2)c2ccccc12	C29H29F3N6O6S	cannabinoid
+O=C(NCC1CCC1)c1nc(OCc2ccccn2)ccc1NC(=O)c1ccc(Cn2ccnn2)c2ccccc12	C31H29N7O3	cannabinoid
+COc1ccc(F)c(-c2c[nH]c(-c3cccc(CN4CCC(F)(F)CC4)c3)n2)c1	C22H22F3N3O	cannabinoid
+O=C(NCC1CCOCC1)c1cnc(Nc2ccc(Cl)cc2Cl)nc1C(F)(F)F	C18H17Cl2F3N4O2	cannabinoid
+COc1ccccc1/N=C1\SCC2(CCCCC2)CN1C(=S)SC	C18H24N2OS3	cannabinoid
+CSC(=S)N1CC2(CCCCC2)CS/C1=N\c1cccc2ccccc12	C21H24N2S3	cannabinoid
+CSC(=S)N1CC2(CCCCC2)CO/C1=N\c1cccc2ccccc12	C21H24N2OS2	cannabinoid
+CSC(=S)N1CC2(CCCCC2)CO/C1=N\c1nc(C(C)(C)C)cs1	C18H27N3OS3	cannabinoid
+CSC(=S)N1CC2(CCCCC2)CO/C1=N\c1cc(C(C)(C)C)no1	C18H27N3O2S2	cannabinoid
+C=CCSC(=S)N1CC2(CCCC2)CS/C1=N\c1cccc2ncccc12	C21H23N3S3	cannabinoid
+CCCCCCOc1ccc(S(=O)(=O)c2cccc3ccccc23)c2ccccc12	C26H26O3S	cannabinoid
+CCCCCCOc1ccc(C(=O)Oc2cccc3cccnc23)c2ccccc12	C26H25NO3	cannabinoid
+O=C(c1cccc2ccccc12)c1ccc(OCCN2CCOCC2)c2ccccc12	C27H25NO3	cannabinoid
+CCOC(=O)c1c(C)cc2nc(COC(=O)NCCO)n(-c3ccccc3S(=O)(=O)NC)c(=O)c2c1C	C24H28N4O8S	cannabinoid
+CCOC(=O)c1c(C)cc2nc(CC)n(-c3cccc4ccccc34)c(=O)c2c1C	C25H24N2O3	cannabinoid
+CNS(=O)(=O)c1ccccc1-n1c(COC(=O)NCC(C)(C)O)nc2cc(C)c(C(=O)OCC3CCC3)c(C)c2c1=O	C29H36N4O8S	cannabinoid
+CCCCCn1cc(-c2nc(CN(CC)CC)cs2)c2ccccc21	C21H29N3S	cannabinoid
+CCCCCn1cc(-c2nc(CN(CCOC)C(C)C)cs2)c2ccccc21	C23H33N3OS	cannabinoid
+CCCCCn1cc(-c2nc(CN(C)CCOC)cs2)c2ccccc21	C21H29N3OS	cannabinoid,prophetic
+c1ccc(Cc2noc(-c3cn(CC4CCCCC4)c4ccccc34)n2)cc1	C24H25N3O	cannabinoid
+CCCCCn1cc(-c2nc(C(C)(C)c3ccccc3)no2)c2ccccc21	C24H27N3O	cannabinoid,prophetic
+CCCCCn1cc(-c2nc(Cc3ccccc3)no2)c2ccccc21	C22H23N3O	cannabinoid
+NC(=O)CN1CCN(Cc2nc(-c3cn(CC4CCOCC4)c4c(Cl)cccc34)ns2)CC1	C23H29ClN6O2S	cannabinoid
+CNC(=O)CN1CCN(Cc2nc(-c3cn(CC4CCOCC4)c4c(Cl)cccc34)no2)C[C@H]1CO	C25H33ClN6O4	cannabinoid
+CCN(CCOC)Cc1nc(-c2cn(CC3CCOCC3)c3c(Cl)cccc23)ns1	C22H29ClN4O2S	cannabinoid
+COCCN(Cc1csc(-c2cn(CC3CCCCC3)c3c(Cl)cccc23)n1)C(C)C	C25H34ClN3OS	cannabinoid
+COCCN(C)Cc1csc(-c2cn(CC3CCOCC3)c3c(Cl)cccc23)n1	C22H28ClN3O2S	cannabinoid
+COc1cccc2c(-c3nnc(CN4CCCC4)s3)cn(CC3CCCCC3)c12	C23H30N4OS	cannabinoid
+CCc1cccc2c(-c3nsc(CN4CCC(C(=O)NCCO)CC4)n3)cn(CC3CCOCC3)c12	C27H37N5O3S	cannabinoid
+CS(=O)(=O)N(CCO)Cc1nc(-c2cn(CC3CCOCC3)c3c(Cl)cccc23)ns1	C20H25ClN4O4S2	cannabinoid
+CN(CC(N)=O)Cc1nc(-c2cn(CC3CCOCC3)c3c(Cl)cccc23)no1	C20H24ClN5O3	cannabinoid
+OC[C@H]1CCCN1Cc1nc(-c2cn(CC3CCOCC3)c3c(Cl)cccc23)ns1	C22H27ClN4O2S	cannabinoid
+CN(C)S(=O)(=O)N(C)Cc1nc(-c2cn(CC3CCOCC3)c3c(Cl)cccc23)no1	C20H26ClN5O4S	cannabinoid
+CCN1CCN(C(=O)c2cn(CC3CCCCC3)c3c(OC)cccc23)CC1(C)C	C25H37N3O2	cannabinoid
+CCN1[C@H](C)CN(C(=O)c2cn(CC3CCCCC3)c3c(OC)cccc23)C[C@@H]1C	C25H37N3O2	cannabinoid
+COc1cccc2c(C(=O)N3C[C@@H](C)N(C)[C@@H](C)C3)cn(CC3CCCCC3)c12	C24H35N3O2	cannabinoid
+O=C(NCc1cccc(F)c1)c1cccc(S(=O)(=O)N2CCCCC2)c1	C19H21FN2O3S	cannabinoid
+COc1cccc2c(C(=O)N3CCN4CCCC[C@H]4C3)cn(CC3CCCCC3)c12	C25H35N3O2	cannabinoid
+C[C@H]1CN(C(=O)c2cn(CCCCCF)c3ccccc23)CCN1C	C20H28FN3O	cannabinoid
+CCCCCn1cc(C(=O)N2C[C@@H](C)N(CC)[C@@H](C)C2)c2ccccc21	C22H33N3O	cannabinoid
+CCN1[C@H](C)CN(C(=O)c2cn(CCCCCF)c3ccccc23)C[C@@H]1C	C22H32FN3O	cannabinoid
+CCCCCn1cc(C(=O)N2CCN(C)CC2)c2ccccc21	C19H27N3O	cannabinoid
+O=C(Nc1cccc2ccccc12)c1cn(CCCCCF)c2ccncc12	C23H22FN3O	cannabinoid
+O=C(Nc1cccc2ccccc12)c1cn(CCCCCF)c2cnccc12	C23H22FN3O	cannabinoid
+O=C(c1cccc2ccccc12)c1cn(CCCCCF)c2ncccc12	C23H21FN2O	cannabinoid
+CC(C)(C)[C@H](NC(=O)n1c(=O)n(CC2CCCCC2)c2cc(F)ccc21)C(N)=O	C21H29FN4O3	cannabinoid
+CCCCCn1cc(C(=O)NC(C)(C)c2ccccc2)c2cccnc21	C22H27N3O	cannabinoid,prophetic
+CC(C)C(NC(=O)c1cn(CCCCCF)c2ncccc12)c1ccccc1	C23H28FN3O	cannabinoid
+CC[C@H](NC(=O)c1cn(CCCCCF)c2ncccc12)C(N)=O	C17H23FN4O2	cannabinoid
+O=C(c1cn(CCCCCF)c2ccccc12)N1CCN(Cc2ccccc2)CC1	C25H30FN3O	cannabinoid
+O=C(On1nnc2ccccc21)c1cn(CCCCCF)c2ncccc12	C19H18FN5O2	cannabinoid
+O=C(NC12CC3CC(CC(C3)C1)C2)c1cn(CCCCCF)c2ncccc12	C23H30FN3O	cannabinoid
+O=C(c1cn(CCCCCF)c2ccccc12)N1CCCC1	C18H23FN2O	cannabinoid
+O=C(c1nn(CCCCCF)c2ccccc12)N1CCCC1	C17H22FN3O	cannabinoid
+CCCCCn1nc(C(=O)Cc2ccccc2)c2ccccc21	C20H22N2O	cannabinoid
+O=C(Oc1cccc2ccccc12)c1nn(Cc2ccccc2F)c2ccccc12	C25H17FN2O2	cannabinoid
+O=C(Oc1ccc2ccccc2c1)c1nn(-c2ccccc2F)c2ccccc12	C24H15FN2O2	cannabinoid
+COC(=O)[C@@H](NC(=O)c1ccc2c(c1)c1ccccc1n2CC1CCCCC1)C(C)(C)C	C27H34N2O3	cannabinoid
+c1ccc(Cc2noc(-c3cn(CCN4CCCC4)c4ccccc34)n2)cc1	C23H24N4O	cannabinoid
+CCCCCn1nc(C(=O)OC23CC4CC(CC(C4)C2)C3)c2ccccc21	C23H30N2O2	cannabinoid
+O=C(OC12CC3CC(CC(C3)C1)C2)c1nn(CCCCCF)c2ccccc12	C23H29FN2O2	cannabinoid
+CCCCCOc1c(OC)ccc2c(C(=O)N[C@@H](Cc3ccccc3)C(=O)OC)c(C)[nH]c12	C26H32N2O5	cannabinoid
+Cc1c(C(=O)N2CCCc3ccccc32)c2ccccc2n1CCN1CCOCC1	C25H29N3O2	cannabinoid
+COC(=O)[C@H](Cc1ccccc1)NC(=O)c1cn(CCN2CCOCC2)c2ncccc12	C24H28N4O4	cannabinoid
+CC(=O)c1c(C)n(CCN2CCOCC2)c2ccccc12	C17H22N2O2	cannabinoid
+CC(C)=CC(=O)c1c(C)n(CCN2CCOCC2)c2ccccc12	C20H26N2O2	cannabinoid
+CCCCCCn1cc(C(=O)c2ccc(OC)c3ccccc23)c2ccccc21	C26H27NO2	cannabinoid
+CCCCCn1cc(C(=O)c2cccc3ccccc23)cc1-c1ccc(F)cc1	C26H24FNO	cannabinoid
+CCCCCn1cc(C(=O)Cc2ccc3c(c2)OCO3)c2ccccc21	C22H23NO3	cannabinoid
+CCCCCn1cc(C(=O)c2cccc3ccccc23)cc1-c1ccccc1CC	C28H29NO	cannabinoid
+CCCCCn1cc(C(=O)c2cccc3ccccc23)cc1-c1cccnc1	C25H24N2O	cannabinoid
+CCCCCn1cc(C(=O)c2cccc3ccccc23)cc1-c1cccc(OC)c1	C27H27NO2	cannabinoid
+CCCCCn1cc(C(=O)c2cccc3ccccc23)cc1-c1ccccc1C(F)(F)F	C27H24F3NO	cannabinoid
+CCCCCn1cc(C(=O)c2ccc3cc(OC)ccc3c2)c2ccccc21	C25H25NO2	cannabinoid
+CCCCCn1c(C)c(C(=O)c2ccc3cc(OC)ccc3c2)c2ccccc21	C26H27NO2	cannabinoid
+CCCCn1c(C)c(C(=O)c2ccc3cc(OC)ccc3c2)c2ccccc21	C25H25NO2	cannabinoid
+CCCCCn1cc(C(=O)c2cccc3ccccc23)c2cc(Br)ccc21	C24H22BrNO	cannabinoid
+CCCCCn1cc(C(=O)c2cccc3ccccc23)c2cc(I)ccc21	C24H22INO	cannabinoid
+COC(=O)[C@H](Cc1ccccc1)NC(=O)c1cc(C)n(CCN2CCOCC2)c1C	C23H31N3O4	cannabinoid
+CCCCCn1cnc(C(=O)N[C@@H](Cc2ccccc2)C(=O)OC)c1	C19H25N3O3	cannabinoid
+CC1(C)[C@@H]2CC[C@@](C)(C2)[C@@H]1NC(=O)c1cc2n(n1)[C@H](CN1CCOCC1)CCO2	C22H34N4O3	cannabinoid
+COc1ccccc1Cn1ccc2c(ccn2CCN2CCOCC2)c1=O	C21H25N3O3	cannabinoid
+Cc1c(C(=O)N[C@@H]2C(C)(C)[C@@H]3CC[C@@]2(C)C3)cc(-c2ccccc2)n1CCN1CCOCC1	C28H39N3O2	cannabinoid
+CC1(C)[C@@H]2CC[C@@](C)(C2)[C@@H]1n1ccc2c(cc(-c3ccccc3)n2CCN2CCOCC2)c1=O	C29H37N3O2	cannabinoid
+CCCCCC1CC(C(=O)c2cccc3ccccc23)c2ccccc21	C25H26O	cannabinoid
+O=C(Oc1cccc2cccnc12)c1cc(-c2ccccc2F)n(CCCCCF)n1	C24H21F2N3O2	cannabinoid
+CCCCCn1nc(C(=O)c2cccc3ccccc23)c2cccnc21	C22H21N3O	cannabinoid
+CCCCCn1nc(C(=O)c2cccc3ccccc23)c2ccncc21	C22H21N3O	cannabinoid
+CCCCCn1cnc(C(=O)c2cccc3ccccc23)c1	C19H20N2O	cannabinoid
+CCCCCN1c2ccccc2SC1C(=O)c1cccc2ccccc12	C23H23NOS	cannabinoid
+CCCCC[s+]1cc(C(=O)c2cccc3ccccc23)c2ccccc21.[Br-]	C24H23OS.BrH	cannabinoid
+O=C(c1cccc2ccccc12)c1nn(CCCCCCl)c2ccccc12	C23H21ClN2O	cannabinoid
+Cc1ccc(C(=O)c2nn(CC3CCOCC3)c3ccccc23)c2ccccc12	C25H24N2O2	cannabinoid
+CC1(C)C(C(=O)c2cn(CCCCCO)c3ccccc23)C1(C)C	C21H29NO2	cannabinoid
+Cc1c(C(=O)c2c3ccccc3cc3ccccc23)c2ccccc2n1CCN1CCOCC1	C30H28N2O2	cannabinoid
+CCCCCn1cc(C(=O)c2cccc3ccccc23)cc1-c1ccccc1Br	C26H24BrNO	cannabinoid
+C=CCCCn1cc(C(=O)C2C(C)(C)C2(C)C)c2ccccc21	C21H27NO	cannabinoid
+C=CCCCn1cc(C(=O)c2ccc(C)c3ccccc23)c2ccccc21	C25H23NO	cannabinoid
+CCCCCn1c2ccccc2c2cc(C(=O)N[C@H](C(=O)OC)C(C)(C)C)ccc21	C25H32N2O3	cannabinoid
+O=C(Nc1ccc2ccccc2c1)c1cn(CCCCCF)c2ccccc12	C24H23FN2O	cannabinoid
+O=C(Oc1cccc2ccccc12)c1cn(CC2CCCCC2)c2ccccc12	C26H25NO2	cannabinoid
+O=C(Oc1cccc2cccnc12)c1nn(CC2CCCCC2)c2ccccc12	C24H23N3O2	cannabinoid
+O=C(Oc1ccnc2ccccc12)c1cn(CCCCCF)c2ccccc12	C23H21FN2O2	cannabinoid
+O=C(Oc1cccc2ncccc12)c1cn(CCCCCF)c2ccccc12	C23H21FN2O2	cannabinoid
+O=C(Oc1cncc2ccccc12)c1cn(CCCCCF)c2ccccc12	C23H21FN2O2	cannabinoid
+O=C(Oc1cccc2cnccc12)c1cn(CCCCCF)c2ccccc12	C23H21FN2O2	cannabinoid
+O=C(Oc1cccc2ccncc12)c1cn(CCCCCF)c2ccccc12	C23H21FN2O2	cannabinoid
+O=C(Oc1ccc2ncccc2c1)c1cn(CCCCCF)c2ccccc12	C23H21FN2O2	cannabinoid
+O=C(Oc1ccc2cccnc2c1)c1cn(CCCCCF)c2ccccc12	C23H21FN2O2	cannabinoid
+O=C(Oc1cnc2ccccc2c1)c1cn(CCCCCF)c2ccccc12	C23H21FN2O2	cannabinoid
+O=C(Oc1ccc2ccncc2c1)c1cn(CCCCCF)c2ccccc12	C23H21FN2O2	cannabinoid
+O=C(Oc1ccc2cnccc2c1)c1cn(CCCCCF)c2ccccc12	C23H21FN2O2	cannabinoid
+COC(=O)[C@@H](NC(=O)n1c(=O)n(CCN2CCOCC2)c2ccccc21)C(C)(C)C	C21H30N4O5	cannabinoid
+CN1CCCCC1Cn1c(=O)n(C(=O)N[C@H](C(N)=O)C(C)(C)C)c2ccccc21	C21H31N5O3	cannabinoid
+CC(C)(C)[C@H](NC(=O)n1c(=O)n(CCN2CCOCC2)c2ncccc21)C(N)=O	C19H28N6O4	cannabinoid
+CC(C)(NC(=O)n1c(=O)n(CCN2CCOCC2)c2ccccc21)c1ccccc1	C23H28N4O3	cannabinoid
+O=C(NC12CC3CC(CC(C3)C1)C2)n1c(=O)n(CCN2CCOCC2)c2ccccc21	C24H32N4O3	cannabinoid
+O=C(Nc1cccc2ccccc12)n1c(=O)n(CCN2CCOCC2)c2ccccc21	C24H24N4O3	cannabinoid
+CC(C)(C)[C@H](NC(=O)n1c(=O)n(CC2CCOCC2)c2ccccc21)C(N)=O	C20H28N4O4	cannabinoid
+CSCCn1c(=O)n(C(=O)N[C@H](C(N)=O)C(C)(C)C)c2cccc(C)c21	C18H26N4O3S	cannabinoid
+O=C(N[C@H]1c2ccccc2C[C@H]1O)n1c(=O)n(CC2CCCCC2)c2ccccc21	C24H27N3O3	cannabinoid
+CCCCCn1c(=O)n(C(=O)N[C@H]2CCCc3ccccc32)c2ccccc21	C23H27N3O2	cannabinoid
+CC(C)(C)[C@H](NC(=O)n1c(=O)n(CC2CCCCC2)c2ccccc21)C(N)=O	C21H30N4O3	cannabinoid
+CC(C)(C)CCn1c(=O)n(C(=O)N[C@H](C(N)=O)C(C)(C)C)c2ccccc21	C20H30N4O3	cannabinoid
+CCCCCn1c(=O)n(C(=O)N[C@H](C(N)=O)C(C)(C)C)c2ccccc21	C19H28N4O3	cannabinoid
+CC(C)(C)[C@H](NC(=O)n1c(=O)n(CCC2CCC2)c2ccccc21)C(N)=O	C20H28N4O3	cannabinoid
+CC(C)(C)[C@H](NC(=O)n1c(=O)n(CCCC2CC2)c2ccccc21)C(N)=O	C20H28N4O3	cannabinoid
+CC(C)(C)[C@H](NC(=O)n1c(=O)n(CCCCC#N)c2ccccc21)C(N)=O	C19H25N5O3	cannabinoid
+CCCCn1c(=O)n(C(=O)N[C@H](C(N)=O)C(C)(C)C)c2ccccc21	C18H26N4O3	cannabinoid
+CC(C)(C)[C@H](NC(=O)n1c(=O)n(CCCC(F)(F)F)c2ccccc21)C(N)=O	C18H23F3N4O3	cannabinoid
+CC(C)(C)[C@H](NC(=O)n1c(=O)n(CC2CC=C(F)CC2)c2ccccc21)C(N)=O	C21H27FN4O3	cannabinoid
+CC(C)(C)[C@H](NC(=O)n1c(=O)n(CC2CCC(F)(F)CC2)c2ccccc21)C(N)=O	C21H28F2N4O3	cannabinoid
+CC(C)(C)[C@H](NC(=O)n1c(=O)n(Cc2ccccc2)c2ccccc21)C(N)=O	C21H24N4O3	cannabinoid
+CC(C)(C)[C@H](NC(=O)n1c(=O)n(Cc2ccccc2F)c2ccccc21)C(N)=O	C21H23FN4O3	cannabinoid
+CC(C)(C)[C@H](NC(=O)n1c(=O)n(Cc2ccc(F)cc2)c2ccccc21)C(N)=O	C21H23FN4O3	cannabinoid
+CC(N)Cc1cc2c(s1)OCO2	C8H11NO2S	unknown
+NCCC1c2ccccc2Cc2ccccc21	C16H17N	unknown
+COc1cc(Br)c(OCCc2ccccc2)cc1CCN	C17H20BrNO2	unknown
+CCN(CC)CC(=O)Nc1c(C)cccc1C	C14H22N2O	unknown
+CCCCCC(C)N	C7H17N	unknown
+CCC(C)CC(C)N	C7H17N	unknown
+CC(C)CCC(C)NC(C)C	C10H23N	unknown
+CNC(C)CCC(C)C	C8H19N	unknown
+CC(N)CC1CC1	C6H13N	unknown
+NCCC1CCC1	C6H13N	unknown
+CC(N)CC1CCC1	C7H15N	unknown
+NCCC1CCCC1	C7H15N	unknown
+CC(N)CC1CCCC1	C8H17N	unknown
+CNC(C)CC1CCCC1	C9H19N	unknown
+CC(CC1CCCC1)N(C)C	C10H21N	unknown
+CCNC(C)CC1CCCC1	C10H21N	unknown
+NCCC1=CCCC1	C7H13N	unknown
+CC(N)CC1=CCCC1	C8H15N	unknown
+NCCC1CCCCC1	C8H17N	unknown
+CC(N)CC1CCCCC1	C9H19N	unknown
+CNC(C)CC1CCCCC1	C10H21N	unknown
+CC(CC1CCCCC1)N(C)C	C11H23N	unknown
+NCCC1=CCCCC1	C8H15N	unknown
+CC(N)CC1=CCCCC1	C9H17N	unknown
+CC(C)(C)[C@@H](CO)NC(=O)n1c(=O)n(CC2CCCCC2)c2ccccc21	C21H31N3O3	cannabinoid
+CC(C)(C)[C@H](NC(=O)n1c(=O)n(Cc2ccncn2)c2ccccc21)C(N)=O	C19H22N6O3	cannabinoid
+Cc1nc(Cn2c(=O)n(C(=O)N[C@H](C(N)=O)C(C)(C)C)c3ccccc32)no1	C18H22N6O4	cannabinoid
+Cc1ncc(Cn2c(=O)n(C(=O)N[C@H](C(N)=O)C(C)(C)C)c3ccccc32)s1	C19H23N5O3S	cannabinoid
+O=C(N[C@H]1CCCc2ccccc21)n1c(=O)n(CC2CCOCC2)c2ccccc21	C24H27N3O3	cannabinoid
+Cc1cc(CNC(=O)n2c(=O)n(CC3CCOCC3)c3ccccc32)c(C)o1	C21H25N3O4	cannabinoid
+Cc1cc(CNC(=O)n2c(=O)n(CC3CCOCC3)c3ccccc32)no1	C19H22N4O4	cannabinoid
+CCc1nc(CNC(=O)n2c(=O)n(CC3CCOCC3)c3ccccc32)cs1	C20H24N4O3S	cannabinoid
+CC(C)(C)[C@H](NC(=O)n1c(=O)n(Cc2ccccc2)c2ccccc21)c1nnc(N)o1	C22H24N6O3	cannabinoid
+CCCCCn1c(=O)n(C(=O)NC(C)(C)c2ccccc2)c2ccccc21	C22H27N3O2	cannabinoid,prophetic
+CCCCCn1c(=O)n(C(=O)c2cccc3ccccc23)c2ccccc21	C23H22N2O2	cannabinoid
+CCCCn1nc(C(=O)NC23CC4CC(CC(C4)C2)C3)c2ccccc21	C22H29N3O	cannabinoid
+O=C(NC12CC3CC(CC(C3)C1)C2)c1nn(CC2CCCCC2)c2ccccc12	C25H33N3O	cannabinoid
+O=C(NC12CC3CC(CC(C3)C1)C2)c1nn(CC2CCOCC2)c2ccccc12	C24H31N3O2	cannabinoid
+O=C(NC12CC3CC(CC(C3)C1)C2)c1nn(CCCCF)c2ccccc12	C22H28FN3O	cannabinoid
+O=C(NC12CC3CC(CC(C3)C1)C2)c1nn(CCN2CCCCC2)c2ccccc12	C25H34N4O	cannabinoid
+O=C(NC12CC3CC(CC(C3)C1)C2)c1nn(Cc2ccc(F)cc2)c2ccccc12	C25H26FN3O	cannabinoid
+O=C(NC12CC3CC(CC(C3)C1)C2)c1nn(CCN2CCOCC2)c2ccccc12	C24H32N4O2	cannabinoid
+CN1CCCCC1Cn1nc(C(=O)NC23CC4CC(CC(C4)C2)C3)c2ccccc21	C25H34N4O	cannabinoid
+N#CCCCCn1nc(C(=O)NC23CC4CC(CC(C4)C2)C3)c2ccccc21	C23H28N4O	cannabinoid
+O=C(NC12CC3CC(CC(C3)C1)C2)c1nn(CCCCCl)c2ccccc12	C22H28ClN3O	cannabinoid
+O=C(NC12CC3CC(CC(C3)C1)C2)c1nn(CCCCI)c2ccccc12	C22H28IN3O	cannabinoid
+O=C(NC12CC3CC(CC(C3)C1)C2)c1nn(CCCCCCl)c2ccccc12	C23H30ClN3O	cannabinoid
+CCCCCn1nc(C(=O)NC2C(C)(C)C2(C)C)c2ccccc21	C20H29N3O	cannabinoid
+CCCCCn1nc(C(=O)NC2CCCCCC2)c2ccccc21	C20H29N3O	cannabinoid
+CCCCCn1nc(C(=O)NC2C3CC4CC(C3)CC2C4)c2ccccc21	C23H31N3O	cannabinoid
+CCCCCn1nc(C(=O)NCCC)c2ccccc21	C16H23N3O	cannabinoid
+CCCCCNC(=O)c1nn(CCCCC)c2ccccc12	C18H27N3O	cannabinoid
+CCCCCCC(C)(C)NC(=O)c1nn(CCCCC)c2ccccc12	C22H35N3O	cannabinoid
+CCCCCn1nc(C(=O)NC[C@H]2CCC3CC2C3(C)C)c2ccccc21	C23H33N3O	cannabinoid
+CCCCCn1nc(C(=O)N[C@@H]2C(C)(C)[C@@H]3CC[C@@]2(C)C3)c2ccccc21	C23H33N3O	cannabinoid
+CCCCCn1nc(C(=O)NCc2ccccc2)c2ccccc21	C20H23N3O	cannabinoid
+CCCCCn1nc(C(=O)NCc2ccc(Cl)c(Cl)c2)c2ccccc21	C20H21Cl2N3O	cannabinoid
+CCCCCn1nc(C(=O)N2CCCc3ccccc32)c2ccccc21	C22H25N3O	cannabinoid
+O=C(NC1C2CC3CC(C2)CC1C3)c1cn(CCCCCF)c2ccccc12	C24H31FN2O	cannabinoid
+CCCCCn1cc(C(=O)NC2C3CC4CC(C3)CC2C4)c2ccccc21	C24H32N2O	cannabinoid
+CCCCCn1cc(C(=O)NC2C3CC4CC(C3)CC2C4)c2ccc(F)cc21	C24H31FN2O	cannabinoid
+O=C(NC1C2CC3CC(C2)CC1C3)c1nn(CC2CCOCC2)c2ccccc12	C24H31N3O2	cannabinoid
+CCCCCn1nc(C(=O)N[C@H](C)c2ccccc2)c2ccccc21	C21H25N3O	cannabinoid
+CCCCCn1nc(C(=O)N[C@H](C)CO)c2ccccc21	C16H23N3O2	cannabinoid
+CCCCCn1cc(C(=O)NC2(c3ccccc3)CCOCC2)c2ccccc21	C25H30N2O2	cannabinoid
+O=C(NCc1ccc(F)cc1F)c1cn(CC2CCOCC2)c2ccccc12	C22H22F2N2O2	cannabinoid
+CCCCCn1c(C)c(C(=O)N[C@@H]2C(C)(C)[C@@H]3CC[C@@]2(C)C3)c2cccc(OC)c21	C26H38N2O2	cannabinoid
+COc1cccc2c(C(=O)NCc3ccccc3)nn(CCN3CCOCC3)c12	C22H26N4O3	cannabinoid
+COc1cccc2c(C(=O)N[C@H]3c4ccccc4C[C@H]3O)nn(CCN3CCOCC3)c12	C24H28N4O4	cannabinoid
+Cc1ccc(CNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cc1	C20H24N2O3S	cannabinoid
+Cc1ccc(Cn2nc(C(=O)N[C@@H]3C(C)(C)[C@@H]4CC[C@@]3(C)C4)cc2-c2ccc(Cl)c(C)c2)cc1	C29H34ClN3O	cannabinoid
+Cc1ccc(Cn2nc(C(=O)NC3CC(C)CCC3C(C)C)c3c2-c2sccc2C3)cc1	C27H33N3OS	cannabinoid
+CC1(C)C2CCC(CNC(=O)c3nn(CCCCCCl)c4c3CCc3sc(Cl)cc3-4)C1C2	C25H33Cl2N3OS	cannabinoid
+Cn1ccc2c(Nc3cccc(Cl)c3)ncc(C(=O)N3CCOCC3)c21	C19H19ClN4O2	cannabinoid
+CC(C)(C)NC(=O)c1nn(-c2ccc(F)cc2F)c2c1[C@H]1CC[C@@H]2C1	C19H21F2N3O	cannabinoid
+CCOc1ccc(Cc2nc3cc(N(C)S(=O)(=O)c4cccs4)ccc3n2CC2CCCCC2)nc1	C27H32N4O3S2	cannabinoid
+CCNC1(C(N)=O)CCN(c2ncnc3c2nc(-c2ccccc2Cl)n3-c2ccc(Cl)cc2)CC1	C25H25Cl2N7O	cannabinoid
+CN/C(=N\S(=O)(=O)c1ccc(Cl)cc1)N1CC(c2ccccc2)C(c2ccc(Cl)cc2)=N1	C23H20Cl2N4O2S	cannabinoid
+C[C@H](NC(=O)C(C)(C)Oc1ccc(C(F)(F)F)cn1)[C@@H](Cc1ccc(Cl)cc1)c1cccc(C#N)c1	C27H25ClF3N3O2	cannabinoid
+COc1ccc2c(c1)c(CC(=O)N1CCOCC1)c(C)n2C(=O)c1ccc(Cl)cc1	C23H23ClN2O4	cannabinoid
+CS(=O)(=O)N(c1cc(F)cc(F)c1)C1CN(C(c2ccc(Cl)cc2)c2ccc(Cl)cc2)C1	C23H20Cl2F2N2O2S	cannabinoid
+O=C(NCc1ccc(F)cc1)c1cn(CC2CCOCC2)c2ccccc12	C22H23FN2O2	cannabinoid
+O=C(NCc1ccc(F)cc1)c1cn(CCCCCF)c2ccccc12	C21H22F2N2O	cannabinoid
+O=C(Nc1cccc(Cl)c1Cl)c1cn(CCCCCF)c2ccccc12	C20H19Cl2FN2O	cannabinoid
+CCCCCn1cc(C(=O)CC23CC4CC(CC(C4)C2)C3)c2ccccc21	C25H33NO	cannabinoid
+CCCCCn1cc(C(=O)NCC23CC4CC(CC(C4)C2)C3)c2ccccc21	C25H34N2O	cannabinoid
+CC(C)c1ccc(C(=O)N2CCC3CCCCC3C2)cc1S(=O)(=O)N1CCCC1	C23H34N2O3S	cannabinoid
+CCCCCn1cc(C(=O)NCC2CCCCC2)c2ccccc21	C21H30N2O	cannabinoid
+CCCCCn1cc(C(=O)Nc2ccccc2)c2ccccc21	C20H22N2O	cannabinoid
+Cc1c(C(=O)NCCc2ccccn2)c2ccccc2n1CCN1CCOCC1	C23H28N4O2	cannabinoid
+COc1cccc2c(C(=O)NC(C)c3ccc(C)cc3)c(C)n(CCN3CCOCC3)c12	C26H33N3O3	cannabinoid
+COc1cccc2c(C(=O)Nc3cccc4ccccc34)nn(CCN3CCOCC3)c12	C25H26N4O3	cannabinoid
+COc1cccc2c(C(=O)NC(C)(C)c3ccccc3)nn(CCN3CCOCC3)c12	C24H30N4O3	cannabinoid
+CCCCCn1cc(C(=O)N[C@@H](Cc2ccccc2)C(N)=O)c2ccccc21	C23H27N3O2	cannabinoid
+CCCCCn1cc(C(=O)N[C@H](C(N)=O)C(C)C)c2ccccc21	C19H27N3O2	cannabinoid
+CCCCCn1cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)OC)c2ccccc21	C24H28N2O3	cannabinoid
+CCCCCn1cc(C(=O)N[C@H](C(=O)OC)C(C)C)c2ccccc21	C20H28N2O3	cannabinoid
+CCCCCn1cc(C(=O)N[C@H](C(=O)OC)C(C)(C)C)c2ccccc21	C21H30N2O3	cannabinoid
+CCCCCn1nc(C(=O)N[C@@H](Cc2ccccc2)C(N)=O)c2ccccc21	C22H26N4O2	cannabinoid
+CCCCCn1nc(C(=O)N[C@H](C(N)=O)C(C)C)c2ccccc21	C18H26N4O2	cannabinoid
+CCCCCn1nc(C(=O)N[C@H](C(N)=O)C(C)(C)C)c2ccccc21	C19H28N4O2	cannabinoid
+CCCCCn1nc(C(=O)N[C@H](C(=O)OC)C(C)C)c2ccccc21	C19H27N3O3	cannabinoid
+CCCCCn1nc(C(=O)N[C@H](C(=O)OC)C(C)(C)C)c2ccccc21	C20H29N3O3	cannabinoid
+NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cn(CCCCCF)c2ccccc12	C23H26FN3O2	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1cn(CCCCCF)c2ccccc12)C(N)=O	C20H28FN3O2	cannabinoid
+COC(=O)[C@@H](NC(=O)c1cn(CCCCCF)c2ccccc12)C(C)C	C20H27FN2O3	cannabinoid
+COC(=O)[C@@H](NC(=O)c1cn(CCCCCF)c2ccccc12)C(C)(C)C	C21H29FN2O3	cannabinoid
+NC(=O)[C@H](Cc1ccccc1)NC(=O)c1nn(CCCCCF)c2ccccc12	C22H25FN4O2	cannabinoid
+CC(C)[C@H](NC(=O)c1nn(CCCCCF)c2ccccc12)C(N)=O	C18H25FN4O2	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1nn(CCCCCF)c2ccccc12)C(N)=O	C19H27FN4O2	cannabinoid
+COC(=O)[C@H](Cc1ccccc1)NC(=O)c1nn(CCCCCF)c2ccccc12	C23H26FN3O3	cannabinoid
+COC(=O)[C@@H](NC(=O)c1nn(CCCCCF)c2ccccc12)C(C)C	C19H26FN3O3	cannabinoid
+COC(=O)[C@@H](NC(=O)c1nn(CCCCCF)c2ccccc12)C(C)(C)C	C20H28FN3O3	cannabinoid
+NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cn(CC2CCCCC2)c2ccccc12	C25H29N3O2	cannabinoid
+CC(C)[C@H](NC(=O)c1cn(CC2CCCCC2)c2ccccc12)C(N)=O	C21H29N3O2	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1cn(CC2CCCCC2)c2ccccc12)C(N)=O	C22H31N3O2	cannabinoid
+COC(=O)[C@@H](NC(=O)c1cn(CC2CCCCC2)c2ccccc12)C(C)C	C22H30N2O3	cannabinoid
+COC(=O)[C@@H](NC(=O)c1cn(CC2CCCCC2)c2ccccc12)C(C)(C)C	C23H32N2O3	cannabinoid
+NC(=O)[C@H](Cc1ccccc1)NC(=O)c1nn(CC2CCCCC2)c2ccccc12	C24H28N4O2	cannabinoid
+CC(C)[C@H](NC(=O)c1nn(CC2CCCCC2)c2ccccc12)C(N)=O	C20H28N4O2	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1nn(CC2CCCCC2)c2ccccc12)C(N)=O	C21H30N4O2	cannabinoid
+COC(=O)[C@H](Cc1ccccc1)NC(=O)c1nn(CC2CCCCC2)c2ccccc12	C25H29N3O3	cannabinoid
+COC(=O)[C@@H](NC(=O)c1nn(CC2CCCCC2)c2ccccc12)C(C)C	C21H29N3O3	cannabinoid
+NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cn(Cc2ccc(F)cc2)c2ccccc12	C25H22FN3O2	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1cn(Cc2ccc(F)cc2)c2ccccc12)C(N)=O	C22H24FN3O2	cannabinoid
+COC(=O)[C@H](Cc1ccccc1)NC(=O)c1cn(Cc2ccc(F)cc2)c2ccccc12	C26H23FN2O3	cannabinoid
+COC(=O)[C@@H](NC(=O)c1cn(Cc2ccc(F)cc2)c2ccccc12)C(C)C	C22H23FN2O3	cannabinoid
+COC(=O)[C@@H](NC(=O)c1cn(Cc2ccc(F)cc2)c2ccccc12)C(C)(C)C	C23H25FN2O3	cannabinoid
+NC(=O)[C@H](Cc1ccccc1)NC(=O)c1nn(Cc2ccc(F)cc2)c2ccccc12	C24H21FN4O2	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1nn(Cc2ccc(F)cc2)c2ccccc12)C(N)=O	C21H23FN4O2	cannabinoid
+COC(=O)[C@H](Cc1ccccc1)NC(=O)c1nn(Cc2ccc(F)cc2)c2ccccc12	C25H22FN3O3	cannabinoid
+COC(=O)[C@@H](NC(=O)c1nn(Cc2ccc(F)cc2)c2ccccc12)C(C)C	C21H22FN3O3	cannabinoid
+COC(=O)[C@@H](NC(=O)c1nn(Cc2ccc(F)cc2)c2ccccc12)C(C)(C)C	C22H24FN3O3	cannabinoid
+COc1cccc2c(C(=O)N[C@@H](Cc3ccccc3)C(N)=O)c(C)n(CCN3CCOCC3)c12	C26H32N4O4	cannabinoid
+CC(C)[C@H](NC(=O)c1nn(CCCC#N)c2ccccc12)C(N)=O	C17H21N5O2	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1nn(CCCC#N)c2ccccc12)C(N)=O	C18H23N5O2	cannabinoid
+COC(=O)[C@H](Cc1ccccc1)NC(=O)c1c(C)n(CCN2CCOCC2)c2c(OC)cccc12	C27H33N3O5	cannabinoid
+COC(=O)[C@H](CCSC)NC(=O)c1c(C)n(CCN2CCOCC2)c2c(OC)cccc12	C23H33N3O5S	cannabinoid
+CC(C)(C)[C@@H](CO)NC(=O)c1nn(CC2CCOCC2)c2ncccc12	C19H28N4O3	cannabinoid
+N#CCCCn1nc(C(=O)N[C@@H](Cc2ccccc2)C(N)=O)c2ccccc21	C21H21N5O2	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1nn(CC2CCCCCC2)c2ccccc12)C(=O)NC1CC1	C25H36N4O2	cannabinoid
+COC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)c1c(C)n(CCN2CCOCC2)c2c(OC)cccc12	C27H33N3O6	cannabinoid
+COC(=O)[C@@H](NC(=O)c1c(C)n(CCN2CCOCC2)c2c(OC)cccc12)C(C)C	C23H33N3O5	cannabinoid
+CC(C)C[C@H](NC(=O)c1nn(CC2CCCCC2)c2ccccc12)C(N)=O	C21H30N4O2	cannabinoid
+COC(=O)[C@H](Cc1ccccc1)NC(=O)c1c(C)n(CCN2CCOCC2)c2ccccc12	C26H31N3O4	cannabinoid
+COc1cccc2c(C(=O)N[C@@H]3C(C)(C)[C@@H]4CC[C@@]3(C)C4)c(C)n(CCN3CCOCC3)c12	C27H39N3O3	cannabinoid
+CCCCCOc1cc(/C=C/C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)OC)ccc1OC	C25H31NO6	cannabinoid
+COC(=O)[C@H](Cc1ccccc1)NC(=O)c1nn(CCN2CCOCC2)c2ccccc12	C24H28N4O4	cannabinoid
+COc1cccc2c(C(=O)N[C@@H]3C(C)(C)[C@@H]4CC[C@@]3(C)C4)nn(CCN3CCOCC3)c12	C25H36N4O3	cannabinoid
+COc1cccc2c(C(=O)N[C@@H]3C[C@H](C)CC[C@H]3C(C)C)nn(CCN3CCOCC3)c12	C25H38N4O3	cannabinoid
+COc1ccc(Cn2c(C)c(C(=O)N[C@@H]3C(C)(C)[C@@H]4CC[C@@]3(C)C4)c3cccc(OC)c32)cc1	C29H36N2O3	cannabinoid
+CCCCn1c2ccn([C@@H]3C(C)(C)[C@@H]4CC[C@@]3(C)C4)c(=O)c2c2cccc(OC)c21	C26H34N2O2	cannabinoid
+COc1cccc2c(C(=O)NC3C(C)(C)CCCC3(C)C)nn(CCN3CCOCC3)c12	C25H38N4O3	cannabinoid
+COc1cccc2c(C(=O)NCc3ccc4c(c3)OCO4)nn(CCN3CCOCC3)c12	C23H26N4O5	cannabinoid
+CCN1CCN(C(=O)c2nn(CCN3CCOCC3)c3c(OC)cccc23)CC1	C21H31N5O3	cannabinoid
+COc1cccc2c(C(=O)Nc3cccc(Cl)c3Cl)nn(CCN3CCOCC3)c12	C21H22Cl2N4O3	cannabinoid
+O=C(NC1CCCCC1)c1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1	C17H23ClN2O3S	cannabinoid
+Cc1ccc(C(=O)N2CCC3CCCCC3C2)cc1S(=O)(=O)NC(C)C	C20H30N2O3S	cannabinoid
+O=C(NC12CC3CC(CC(C3)C1)C2)c1cccc(S(=O)(=O)N2CCOCC2)c1	C21H28N2O4S	cannabinoid
+CC1(C)C2CCC(CNC(=O)c3ccc(Br)c(S(=O)(=O)N4CCCCC4)c3)C1C2	C22H31BrN2O3S	cannabinoid
+O=C(NCc1ccccc1)c1ccc(Br)c(S(=O)(=O)N2CCOCC2)c1	C18H19BrN2O4S	cannabinoid
+Cc1ccc(C(=O)N[C@@H]2CC3CCC2C3)cc1S(=O)(=O)N1CCOCC1	C19H26N2O4S	cannabinoid
+Cc1ccc(C(=O)NC2CC(C)CC(C)(C)C2)cc1S(=O)(=O)N1CCOCC1	C21H32N2O4S	cannabinoid
+O=C(Oc1cccc2cccnc12)c1cccc(S(=O)(=O)N2CCCCCC2)c1	C22H22N2O4S	cannabinoid
+Cc1c(C(=O)NN2CCCCC2)nn(-c2ccc(Cl)cc2Cl)c1-c1ccc(I)cc1	C22H21Cl2IN4O	cannabinoid
+Cc1c(C(=O)NN2CCOCC2)nn(-c2ccc(Cl)cc2Cl)c1-c1ccc(I)cc1	C21H19Cl2IN4O2	cannabinoid
+COc1ccc(C(=O)c2c(C)n(CCN3CCOCC3)c3cc(I)ccc23)cc1	C23H25IN2O3	cannabinoid
+CCCCCn1cc(C(=O)c2ccccc2I)c2ccccc21	C20H20INO	cannabinoid
+O=C(c1ccccc1I)c1cn(CCCCCF)c2ccccc12	C20H19FINO	cannabinoid
+O=C(c1ccccc1I)c1cn(CCCCCCl)c2ccccc12	C20H19ClINO	cannabinoid
+CN1CCCCC1Cn1cc(C(=O)c2cccc3ccccc23)c2ccccc21	C26H26N2O	cannabinoid
+CN1CCCCC(n2cc(C(=O)c3cccc4ccccc34)c3ccccc32)C1	C26H26N2O	cannabinoid
+Cc1c(C(=O)c2cccc3ccccc23)c2ccc([N+](=O)[O-])cc2n1CC1CCCCN1C	C27H27N3O3	cannabinoid
+O=C(c1cccc2ccccc12)c1cn(CCCCCF)c2cc([N+](=O)[O-])ccc12	C24H21FN2O3	cannabinoid
+CN1CCCCC1Cn1cc(C(=O)c2cc([N+](=O)[O-])ccc2I)c2ccccc21	C22H22IN3O3	cannabinoid
+CN1CCCCC1Cn1cc(C(=O)C23CC4CC(CC(C4)C2)C3)c2ccccc21	C26H34N2O	cannabinoid
+O=C(c1cccc2ccccc12)c1cn(CCCCCF)c2ccccc12	C24H22FNO	cannabinoid
+COc1ccc(C(=O)c2cn(CCCCCF)c3ccccc23)c2ccccc12	C25H24FNO2	cannabinoid
+O=C(c1cccc2ccccc12)c1nc2ccccc2n1CCCCCF	C23H21FN2O	cannabinoid
+N#CCCCCn1cc(C(=O)c2cccc3ccccc23)c2ccccc21	C24H20N2O	cannabinoid
+CC(C)(NC(=O)c1nn(CCCCCF)c2ccccc12)c1ccccc1	C22H26FN3O	cannabinoid
+Cc1c(C(=O)NN2CCCCC2)nn(-c2ccc(Cl)cc2Cl)c1-c1ccc(Cl)cc1	C22H21Cl3N4O	cannabinoid
+COc1cccc2c(C(=O)NC3C(C)(C)CCCC3(C)C)cn(CCN3CCOCC3)c12	C26H39N3O3	cannabinoid
+COc1cc(F)cc2c(C(=O)N[C@@H]3C(C)(C)[C@@H]4CC[C@@]3(C)C4)c(C)n(CCN3CCOCC3)c12	C27H38FN3O3	cannabinoid
+COc1cccc2c(C(=O)N[C@H]3CCCc4ccccc43)nn(CCN3CCOCC3)c12	C25H30N4O3	cannabinoid
+COc1cccc2c(C(=O)NCC34CC5CC(CC(C5)C3)C4)nn(CCN3CCOCC3)c12	C26H36N4O3	cannabinoid
+COc1cccc2c(C(=O)NC[C@H]3CCCO3)nn(CCN3CCOCC3)c12	C20H28N4O4	cannabinoid
+COc1cccc2c(C(=O)NCC3CCCCC3)nn(CCN3CCOCC3)c12	C22H32N4O3	cannabinoid
+NC(=O)[C@@H](NC(=O)c1nn(Cc2ccc(F)cc2)c2ccccc12)c1ccccc1	C23H19FN4O2	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1nn(Cc2ccccn2)c2ccccc12)C(N)=O	C20H23N5O2	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1nn(Cc2ccccc2)c2ncccc12)C(N)=O	C20H23N5O2	cannabinoid
+COc1cccc2c(C(=O)NC3C(C)(C)CCCC3(C)C)c(C)n(CCN3CCOCC3)c12	C27H41N3O3	cannabinoid
+CCCCn1nc(C(=O)NC(C)(C)c2ccccc2)c2ccccc21	C21H25N3O	cannabinoid
+CCCn1nc(C(=O)NC(C)(C)c2ccccc2)c2ccccc21	C20H23N3O	cannabinoid
+CCCCCn1nc(C(=O)NC(C)(C)c2ccccc2)c2ccccc21	C22H27N3O	cannabinoid
+CCCCCCn1nc(C(=O)NC(C)(C)c2ccccc2)c2ccccc21	C23H29N3O	cannabinoid
+CCCCCCCn1nc(C(=O)NC(C)(C)c2ccccc2)c2ccccc21	C24H31N3O	cannabinoid
+CC(C)(C)CCn1nc(C(=O)NC(C)(C)c2ccccc2)c2ccccc21	C23H29N3O	cannabinoid
+CC(C)(NC(=O)c1nn(CC2CCCCC2)c2ccccc12)c1ccccc1	C24H29N3O	cannabinoid
+CC(C)(NC(=O)c1nn(CC2CCCCCC2)c2ccccc12)c1ccccc1	C25H31N3O	cannabinoid,prophetic
+CC(C)(NC(=O)c1nn(CC2CC3CCC2C3)c2ccccc12)c1ccccc1	C25H29N3O	cannabinoid
+CC(C)(NC(=O)c1nn(CC2C3CC4CC(C3)CC2C4)c2ccccc12)c1ccccc1	C28H33N3O	cannabinoid
+CC(C)(NC(=O)c1nn(CC2CCC(F)(F)CC2)c2ccccc12)c1ccccc1	C24H27F2N3O	cannabinoid
+CCCCCn1nc(C(=O)NC(C)(C)C2CCCCC2)c2ccccc21	C22H33N3O	cannabinoid
+CC(C)(NC(=O)c1nn(CC2CCOCC2)c2ccccc12)c1ccccc1	C23H27N3O2	cannabinoid
+CCCCn1cc(C(=O)NC(C)(C)c2ccccc2)c2ccccc21	C22H26N2O	cannabinoid
+CCCCCn1cc(C(=O)NC(C)(C)c2ccccc2)c2ccccc21	C23H28N2O	cannabinoid
+CC(C)(NC(=O)c1cn(CCCCCF)c2ccccc12)c1ccccc1	C23H27FN2O	cannabinoid
+CC(C)(NC(=O)c1nn(Cc2ccc(F)cc2)c2ccccc12)c1ccccc1	C24H22FN3O	cannabinoid
+CN1CCCCC1Cn1nc(C(=O)NC(C)(C)c2ccccc2)c2ccccc21	C24H30N4O	cannabinoid
+CC(C)(NC(=O)c1nn(CCN2CCOCC2)c2ccccc12)c1ccccc1	C23H28N4O2	cannabinoid
+CC(C)(NC(=O)c1nn(CCN2CCCCC2)c2ccccc12)c1ccccc1	C24H30N4O	cannabinoid
+CC(C)(NC(=O)c1nn(CCN2CCC(F)(F)CC2)c2ccccc12)c1ccccc1	C24H28F2N4O	cannabinoid
+CC(C)(NC(=O)c1cn(CC2CCCCC2)c2ccccc12)c1ccccc1	C25H30N2O	cannabinoid
+CC(C)(NC(=O)c1cn(CC2CCOCC2)c2ccccc12)c1ccccc1	C24H28N2O2	cannabinoid
+CC(C)(NC(=O)c1nn(CCCCC#N)c2ccccc12)c1ccccc1	C22H24N4O	cannabinoid
+CCCCCn1nc(C(=O)NC(C)(C)c2ccc(Cl)cc2)c2ccccc21	C22H26ClN3O	cannabinoid
+CC(C)(NC(=O)c1cn(CCCCCF)c2ccccc12)c1ccc(F)cc1	C23H26F2N2O	cannabinoid
+CC(C)(NC(=O)c1nn(CCCCCF)c2ccccc12)c1ccc(F)cc1	C22H25F2N3O	cannabinoid
+CC(C)(NC(=O)c1cn(CCCC(F)(F)F)c2ccccc12)c1ccccc1	C22H23F3N2O	cannabinoid
+CC(C)(NC(=O)c1nn(CCCCCF)c2ccccc12)c1ccc(Cl)cc1	C22H25ClFN3O	cannabinoid
+CCC(C)(NC(=O)c1nn(CCCCCF)c2ccccc12)c1ccccc1	C23H28FN3O	cannabinoid
+O=C(NC1(c2ccccc2)CC1)c1nn(CCCCCF)c2ccccc12	C22H24FN3O	cannabinoid
+CCCCCn1cc(C(=O)NC2(c3ccccc3)CCCC2)c2ccccc21	C25H30N2O	cannabinoid
+CC(C)(OC(=O)c1nn(CCCCCF)c2ccccc12)c1ccccc1	C22H25FN2O2	cannabinoid
+CCCCCn1cc(NC(=O)C(C)(C)c2ccccc2)c2ccccc21	C23H28N2O	cannabinoid
+O=C(O)CCCCCCNC1c2ccccc2CCc2ccccc21	C22H27NO2	unknown
+CCCCCc1cc(O)c2c(c1)OC(C)(C)[C@@H]1CCC(C)=C[C@@H]21	C21H30O2	cannabinoid
+CCCCCc1cc(O)c2c(c1)OC(C)(C)[C@@H]1CC=C(C)C[C@@H]21	C21H30O2	cannabinoid
+CCCCCc1cc(O)c2c(c1)OC(C)(C)[C@@H]1CCC(C)C[C@@H]21	C21H32O2	cannabinoid
+CCCc1cc(O)c2c(c1)OC(C)(C)[C@@H]1CCC(C)=C[C@@H]21	C19H26O2	cannabinoid
+CCCCc1cc(O)c2c(c1)OC(C)(C)[C@@H]1CCC(C)=C[C@@H]21	C20H28O2	cannabinoid
+CCCCCCc1cc(O)c2c(c1)OC(C)(C)[C@@H]1CCC(C)=C[C@@H]21	C22H32O2	cannabinoid
+CCCCCCCc1cc(O)c2c(c1)OC(C)(C)[C@@H]1CCC(C)=C[C@@H]21	C23H34O2	cannabinoid
+CCCCCc1cc(O)c2c(c1)OC(C)(C)c1ccc(C)cc1-2	C21H26O2	cannabinoid
+CCCCCc1cc2c(c(O)c1C(=O)O)[C@@H]1C=C(C)CC[C@H]1C(C)(C)O2	C22H30O4	cannabinoid
+CCCCCc1cc(O)c2c(c1)OC(C)(C)[C@H]1CCC(C)=C[C@@H]21	C21H30O2	cannabinoid
+CCCCCc1cc(O)c2c(c1)OC(C)(C)[C@H]1CCC(C)=C[C@H]21	C21H30O2	cannabinoid
+CC1=C[C@H]2c3c(O)cc(CCc4ccccc4)cc3OC(C)(C)[C@H]2CC1	C24H28O2	cannabinoid
+CCCCCc1cc(O)c2c(c1)OC(C)(C)C1=C2CC(C)CC1	C21H30O2	cannabinoid
+CCCCCc1cc(O)c2c(c1)OC(C)(C)[C@@H]1CCC(C)C=C21	C21H30O2	cannabinoid
+CCCCCc1cc(O)c2c(c1)OC(C)(C)[C@@H]1C=CC(C)C[C@@H]21	C21H30O2	cannabinoid
+CCCCCc1cc(O)c2c(c1)OC(C)(C)C1=CCC(C)C[C@H]12	C21H30O2	cannabinoid
+CCCCCc1cc(O)c2c(c1)OC(C)(C)[C@@H]1CCC(CO)=C[C@@H]21	C21H30O3	cannabinoid
+CCCCCc1cc(O)c2c(c1)OC(C)(C)[C@@H]1CCC(C(=O)O)=C[C@@H]21	C21H28O4	cannabinoid
+CCCCCc1cc(OC(C)=O)c2c(c1)OC(C)(C)[C@@H]1CCC(C)=C[C@@H]21	C23H32O3	cannabinoid
+CCCCCc1cc(OC(=O)CC)c2c(c1)OC(C)(C)[C@@H]1CCC(C)=C[C@@H]21	C24H34O3	cannabinoid
+CCCCCc1cc2c(c(OP(=O)(O)O)c1)[C@@H]1CC(C)=CC[C@H]1C(C)(C)O2	C21H31O5P	cannabinoid
+CCCCCc1cc2c(c(OS(=O)(=O)O)c1)[C@@H]1C=C(C)CC[C@H]1C(C)(C)O2	C21H30O5S	cannabinoid
+CCCCCc1cc(OC(=O)CCC(=O)O)c2c(c1)OC(C)(C)[C@@H]1CCC(C)=C[C@@H]21	C25H34O5	cannabinoid
+CCCCCc1cc(OC(=O)CCCN2CCOCC2)c2c(c1)OC(C)(C)[C@@H]1CCC(C)=C[C@@H]21	C29H43NO4	cannabinoid
+CCCCCCc1cc(O)c2c(c1)OC(C)(C)C1=C2CC(C)CC1	C22H32O2	cannabinoid
+CCCCCC(C)C(C)c1cc(O)c2c(c1)OC(C)(C)C1=C2CC(C)CC1	C25H38O2	cannabinoid
+CCCCC[C@@H](C)[C@H](C)c1cc(OC(C)=O)c2c(c1)OC(C)(C)C1=C2C[C@H](C)CC1	C27H40O3	cannabinoid
+CCCCCCC(C)(C)c1cc(O)c2c(c1)OC(C)(C)[C@@H]1CC=C(C)C[C@@H]21	C25H38O2	cannabinoid
+CCC(O)CCc1cc(O)c2c(c1)OC(C)(C)[C@@H]1CCC(C)=C[C@@H]21	C21H30O3	cannabinoid
+CCCCCCC(C)(C)c1cc(O)c2c(c1)OC(C)(C)[C@@H]1CC=C(CO)C[C@@H]21	C25H38O3	cannabinoid
+CCCCCCC(C)(C)c1cc(O)c2c(c1)OC(C)(C)[C@H]1CC=C(CO)C[C@H]21	C25H38O3	cannabinoid
+CCCCCCC(C)(C)c1cc(O)c2c(c1)OC(C)(C)[C@@H]1CC[C@@H](CO)C[C@@H]21	C25H40O3	cannabinoid
+CCCCC(C)(C)c1cc(O)c2c(c1)OC(C)(C)[C@@H]1CC=C(C)C[C@@H]21	C23H34O2	cannabinoid
+CCCCCCC(C)(C)c1cc(O)c2c(c1)OC(C)(C)[C@@H]1CC=C(C(=O)O)C[C@@H]21	C25H36O4	cannabinoid
+CCCCCc1cc(O)c2c(c1)OC(C)(C)[C@@H]1CC[C@@H](O)C[C@@H]21	C20H30O3	cannabinoid
+CCCCCCC(C)(C)c1cc(O)c2c(c1)OC(C)(C)[C@@H]1CC[C@@H](O)C[C@@H]21	C24H38O3	cannabinoid
+CCCCCc1cc(N)c2c(c1)OC(C)(C)C1=C2CC(C)CC1	C21H31NO	cannabinoid
+CCCCCC(=O)/C=C/c1cc(O)c2c(c1)OC(C)(C)[C@@H]1CC=C(C)C[C@@H]21	C24H32O3	cannabinoid
+CC1=CC[C@@H]2[C@@H](C1)c1c(O)cc(C(C)(C)c3ccccc3)cc1OC2(C)C	C25H30O2	cannabinoid
+CC1=CC[C@@H]2[C@@H](C1)c1c(O)cc(-c3cccc4ccccc34)cc1OC2(C)C	C26H26O2	cannabinoid
+CC1=CC[C@@H]2[C@@H](C1)c1c(O)cc(C(C)(C)CCCCBr)cc1OC2(C)C	C23H33BrO2	cannabinoid
+CC1=CC[C@@H]2[C@@H](C1)c1c(O)cc(C34CC5CC(CC(C5)C3)C4)cc1OC2(C)C	C26H34O2	cannabinoid
+CCCCC[C@@H](C)[C@H](C)c1cc(O)c2c(c1)OC(C)(C)[C@@H]1CC=C(C)C[C@@H]21	C25H38O2	cannabinoid
+CCCCCCC(C)(C)c1cc(O)c2c(c1)oc(=O)c1ccc(O)cc12	C22H26O4	cannabinoid
+CCCCCCC1(c2cc(O)c3c(c2)OC(C)(C)[C@@H]2CC=C(C)C[C@@H]32)SCCS1	C25H36O2S2	cannabinoid
+CCCCCCC1(c2cc(O)c3c(c2)OC(C)(C)[C@@H]2CC=C(C)C[C@@H]32)CCCC1	C27H40O2	cannabinoid
+CCCCCCC1(c2cc(O)c3c(c2)OC(C)(C)[C@@H]2CC=C(C)C[C@@H]32)CC1	C25H36O2	cannabinoid
+CCC[C@H]1CC[C@](C)(c2cc(O)c3c(c2)OC(C)(C)[C@@H]2CC=C(C)C[C@@H]32)CC1	C26H38O2	cannabinoid
+CCCCCCC(C)(C)c1cc(O)c2c(c1)OC(C)(C)[C@@H]1CCC(=O)C[C@@H]21	C24H36O3	cannabinoid
+CC1=CC[C@@H]2[C@@H](C1)c1c(O)cc(CC34CC5CC(CC(C5)C3)C4)cc1OC2(C)C	C27H36O2	cannabinoid
+CC1=CC[C@@H]2[C@@H](C1)c1c(O)cc(C3CC4CCC3(C)C4(C)C)cc1OC2(C)C	C26H36O2	cannabinoid
+CCCCC/C=C/c1cc(O)c2c(c1)OC(C)(C)[C@@H]1CC[C@@H](CO)C[C@@H]21	C23H34O3	cannabinoid
+CCCCC/C=C\c1cc(O)c2c(c1)OC(C)(C)[C@@H]1CC[C@@H](CO)C[C@@H]21	C23H34O3	cannabinoid
+CC1=CC[C@@H]2[C@@H](C1)c1c(O)cc(C(C)(C)C3CCCCC3)cc1OC2(C)C	C25H36O2	cannabinoid
+CC1=CC[C@@H]2[C@@H](C1)c1c(O)cc(C3(c4ccccc4)SCCS3)cc1OC2(C)C	C25H28O2S2	cannabinoid
+CCCCCCC1(c2cc(O)c3c(c2)OC(C)(C)[C@@H]2CC[C@@H](O)C[C@@H]32)CCC1	C25H38O3	cannabinoid
+CCCCCC(C)C(C)c1cc(O)c2c(c1)OC(C)(C)C1=C2CCCS1	C23H34O2S	cannabinoid
+CCCCCC(C)C(C)c1cc(O)c2c(c1)OC(C)(C)C=C2c1ccncc1	C25H33NO2	cannabinoid
+C#CCN1CCC2=C(C1)c1c(O)cc(C(C)C(C)CCCCC)cc1OC2(C)C	C26H37NO2	cannabinoid
+C#CCN1CCC2=C(C1)c1c(O)cc(C(C)CCCc3ccc(F)cc3)cc1OC2(C)C	C28H32FNO2	cannabinoid
+CCCCCCC1(c2cc(O)c3c(c2)OC(C)(C)[C@@H]2CC=C(C)C[C@@H]32)CCC1	C26H38O2	cannabinoid
+CCCCCCC1(c2cc(O)c3c(c2)OC(C)(C)[C@@H]2CC=C(C)C[C@@H]32)OCCO1	C25H36O4	cannabinoid
+CCCCCCC1(c2cc(O)c3c(c2)OC(C)(C)[C@@H]2CC=C(C)C[C@@H]32)SCCCS1	C26H38O2S2	cannabinoid
+Fc1ccc(C(OCCN2CCN(CCCc3ccccc3)CC2)c2ccc(F)cc2)cc1	C28H32F2N2O	unknown
+Cc1cc2cc(O)c(O)cc2n1C	C10H11NO2	unknown
+O=Cc1ccc2c(c1)OCO2	C8H6O3	unknown
+CC(N)CCCc1ccc2c(c1)OCO2	C12H17NO2	unknown
+CNC(C)CCCc1ccc2c(c1)OCO2	C13H19NO2	unknown
+O=[N+]([O-])/C=C/c1ccc2c(c1)OCO2	C9H7NO4	unknown
+O=[N+]([O-])CCc1ccc2c(c1)OCO2	C9H9NO4	unknown
+C/C(=C\c1ccc2c(c1)OCO2)[N+](=O)[O-]	C10H9NO4	unknown
+CC(N)Cc1csc2ccccc12	C11H13NS	unknown
+NCCC1=CC(=O)C(O)C=C1	C8H11NO2	unknown
+NCCC1=CC(=O)C(=O)C=C1	C8H9NO2	unknown
+CC(N)Cc1ccc2nc[nH]c2c1	C10H13N3	unknown
+C=CCC(C(=O)c1ccc2c(c1)CCCC2)N1CCCC1	C19H25NO	beta-ketone
+COc1ccccc1CCNCc1ccccc1OC	C17H21NO2	unknown
+Oc1ccccc1CNCCc1ccccc1	C15H17NO	unknown
+COc1ccccc1CNCCc1ccccc1	C16H19NO	unknown
+C=CCOc1ccc(CCNCc2ccccc2O)cc1OC	C19H23NO3	unknown
+Oc1ccc2ccccc2c1CNCCc1ccccc1	C19H19NO	unknown
+C=CCOc1ccc(CCNCc2ccccc2OC)cc1OC	C20H25NO3	unknown
+COC(CN)c1ccccc1	C9H13NO	unknown
+CCOCCOc1c(OC)cc(CCN)cc1OC	C14H23NO4	unknown
+CNC(C)CCc1ccccc1	C11H17N	unknown
+CCN(C)CCc1c[nH]c2ccc(C)cc12	C14H20N2	tryptamine
+CCOc1c(OC)cc(CCNCc2cc(OC)ccc2OC)cc1OC	C21H29NO5	unknown
+COc1ccc(OC)c(CNCCc2ccc(OC)c(OC)c2)c1	C19H25NO4	unknown
+C=CCOc1ccc(CC(C)N)cc1OC	C13H19NO2	unknown
+CCOc1cc([N+](=O)[O-])c(CC(C)N)cc1OC	C12H18N2O4	unknown
+CCC(N)Cc1ccccc1F	C10H14FN	unknown
+COc1ccc(CC(C)N)cc1Cl	C10H14ClNO	unknown
+COc1ccc(CC(C)N)cc1[N+](=O)[O-]	C10H14N2O3	unknown
+COc1c(Br)cc(CC(C)N)cc1Br	C10H13Br2NO	unknown
+Cc1ccc(CC(C)N)cc1[N+](=O)[O-]	C10H14N2O2	unknown
+CNC(C)Cc1ccccc1C	C11H17N	unknown
+Cc1ccc(C(=O)C(C)NCCc2ccccc2)cc1	C18H21NO	beta-ketone
+CNC(C)C(O)c1ccc(C)cc1	C11H17NO	unknown
+CCCCCCC(C)(C)c1ccc([C@H]2CCC[C@@H](O)C2)c(O)c1	C21H34O2	cannabinoid
+CCCCCC(C)(C)c1ccc([C@H]2CCC[C@@H](O)C2)c(O)c1	C20H32O2	cannabinoid
+CCCCCCCC(C)(C)c1ccc([C@H]2CCC[C@@H](O)C2)c(O)c1	C22H36O2	cannabinoid
+CCCCCCCCC(C)(C)c1ccc([C@H]2CCC[C@@H](O)C2)c(O)c1	C23H38O2	cannabinoid
+CCCCCCCCCCC(C)(C)c1ccc([C@H]2CCC[C@@H](O)C2)c(O)c1	C25H42O2	cannabinoid
+CCCCCc1ccc([C@H]2CCC[C@@H](O)C2)c(O)c1	C17H26O2	cannabinoid
+Oc1cc(CCCCCF)ccc1[C@H]1CCC[C@@H](O)C1	C17H25FO2	cannabinoid
+Oc1cc(CC2CCCCC2)ccc1[C@H]1CCC[C@@H](O)C1	C19H28O2	cannabinoid
+Oc1cc(CCC2CCCCC2)ccc1[C@H]1CCC[C@@H](O)C1	C20H30O2	cannabinoid
+CN1CCCCC1Cc1ccc([C@H]2CCC[C@@H](O)C2)c(O)c1	C19H29NO2	cannabinoid
+Oc1cc(CCN2CCOCC2)ccc1[C@H]1CCC[C@@H](O)C1	C18H27NO3	cannabinoid
+C=CCCCc1ccc([C@H]2CCC[C@@H](O)C2)c(O)c1	C17H24O2	cannabinoid
+CCCCCCC(C)(C)c1ccc([C@H]2CCC[C@H](O)C2)c(O)c1	C21H34O2	cannabinoid
+CCCCCCCC(C)(C)c1ccc([C@H]2CCC[C@H](O)C2)c(O)c1	C22H36O2	cannabinoid
+CCCCCCC(C)(C)c1ccc([C@@H]2C[C@H](O)CC[C@H]2CCCO)c(O)c1	C24H40O3	cannabinoid
+CCCCCCC(C)(C)c1ccc([C@@H]2C[C@@H](O)CC[C@H]2CCCO)c(O)c1	C24H40O3	cannabinoid
+CCCCCCC(C)(C)c1ccc([C@@H]2C[C@H](O)C[C@@H]3CC[C@H](CO)C[C@H]32)c(O)c1	C26H42O3	cannabinoid
+CCCCCCCn1cc(C(=O)C2C(C)(C)C2(C)C)c2ccccc21	C23H33NO	cannabinoid
+CC1(C)C(C(=O)c2cn(CCN3CCOCC3)c3ccccc23)C1(C)C	C22H30N2O2	cannabinoid
+CC1(C)C(C(=O)c2cn(CC3CCOCC3)c3ccccc23)C1(C)C	C22H29NO2	cannabinoid
+COCCn1c(C)c(C)s/c1=N\C(=O)C1C(C)(C)C1(C)C	C16H26N2O2S	cannabinoid
+CCCCCn1cc(C(=O)C2C(C)(C)C2(C)C)c2ccccc21	C21H29NO	cannabinoid
+CC1(C)C(C(=O)c2cn(CCCCCF)c3ccccc23)C1(C)C	C21H28FNO	cannabinoid
+O=C(Oc1cccc2cccnc12)c1cn(CC2CCCCC2)c2ccccc12	C25H24N2O2	cannabinoid
+CCCCCn1cc(C(=O)Oc2cccc3cccnc23)c2ccccc21	C23H22N2O2	cannabinoid
+O=C(Oc1cccc2cccnc12)c1cn(CCCCCF)c2ccccc12	C23H21FN2O2	cannabinoid
+O=C(Oc1cccc2cccnc12)c1cn(Cc2ccc(F)cc2)c2ccccc12	C25H17FN2O2	cannabinoid
+O=C(Oc1cccc2ccccc12)c1cn(Cc2ccc(F)cc2)c2ccccc12	C26H18FNO2	cannabinoid
+Cc1ccc(C(=O)c2cn(CCCCCF)c3ccccc23)c2ccccc12	C25H24FNO	cannabinoid
+CCc1ccc(C(=O)c2cn(CCCCCF)c3ccccc23)c2ccccc12	C26H26FNO	cannabinoid
+CCCCCn1nc(C(=O)Nc2cccc3ccccc23)c2ccccc21	C23H23N3O	cannabinoid
+O=C(Nc1cccc2ccccc12)c1nn(CCCCCF)c2ccccc12	C23H22FN3O	cannabinoid
+CCCCCn1cc(C(=O)Nc2cccc3ccccc23)c2ccccc21	C24H24N2O	cannabinoid
+O=C(Nc1cccc2ccccc12)c1cn(CCCCCF)c2ccccc12	C24H23FN2O	cannabinoid
+O=C(Nc1cccc2ccccc12)c1cn(CCCCCCl)c2ccccc12	C24H23ClN2O	cannabinoid
+CCCCCn1nc(C(=O)Oc2cccc3ccccc23)c2ccccc21	C23H22N2O2	cannabinoid
+O=C(Oc1cccc2ccccc12)c1nn(CCCCCF)c2ccccc12	C23H21FN2O2	cannabinoid
+CC1(C)C(C(=O)c2cn(CCCCCBr)c3ccccc23)C1(C)C	C21H28BrNO	cannabinoid
+O=C(Nc1cccc2cccnc12)c1nn(CCCCCF)c2ccccc12	C22H21FN4O	cannabinoid
+CCCCCn1nc(C(=O)Nc2cccc3cccnc23)c2ccccc21	C22H22N4O	cannabinoid
+CCc1ccc(CC(C)N)cc1	C11H17N	unknown
+CCNC(C)Cc1ccc(C)c(C)c1	C13H21N	unknown
+CC(c1ccccc1)N1CCNCC1	C12H18N2	unknown
+COc1ccccc1CN1CCNCC1	C12H18N2O	unknown
+COc1cccc(CN2CCNCC2)c1	C12H18N2O	unknown
+COc1ccc(CN2CCNCC2)cc1	C12H18N2O	unknown
+Cc1ccccc1CN1CCNCC1	C12H18N2	unknown
+Cc1ccc(CN2CCNCC2)cc1	C12H18N2	unknown
+c1ccc(CN2CCOCC2)cc1	C11H15NO	unknown
+CC1(C)C(C(=O)c2cn(CCCCCCl)c3ccccc23)C1(C)C	C21H28ClNO	cannabinoid
+CC1(C)C(C(=O)c2cn(CCCCC#N)c3ccccc23)C1(C)C	C21H26N2O	cannabinoid
+CCCn1cc(C(=O)C2C(C)(C)C2(C)C)c2ccccc21	C19H25NO	cannabinoid
+CCCCCCn1cc(C(=O)C2C(C)(C)C2(C)C)c2ccccc21	C22H31NO	cannabinoid
+CCCCCn1cc(C(=O)c2ccc(OC)cc2)c2ccccc21	C21H23NO2	cannabinoid
+CCCCCn1cc(C(=O)c2ccccc2OC)c2ccccc21	C21H23NO2	cannabinoid
+CCCCn1cc(C(=O)c2ccc(OC)cc2)c2ccccc21	C20H21NO2	cannabinoid
+COc1ccccc1CC(=O)c1cn(CC2CCCCN2C)c2ccccc12	C24H28N2O2	cannabinoid
+CCCCCn1nc(C(=O)NC23CC4CC(CC(C4)C2)C3)c2ccccc21	C23H31N3O	cannabinoid
+CCCCCn1cc(C(=O)NC23CC4CC(CC(C4)C2)C3)c2ccccc21	C24H32N2O	cannabinoid
+O=C(NC12CC3CC(CC(C3)C1)C2)c1nn(CCCCCF)c2ccccc12	C23H30FN3O	cannabinoid
+O=C(NC12CC3CC(CC(C3)C1)C2)c1cn(CCCCCF)c2ccccc12	C24H31FN2O	cannabinoid
+CCCCCn1cc(C(=O)C23CC4CC(CC(C4)C2)C3)c2ccccc21	C24H31NO	cannabinoid
+O=C(c1cn(CCCCCF)c2ccccc12)C12CC3CC(CC(C3)C1)C2	C24H30FNO	cannabinoid
+CCOC(=O)[C@@H](NC(=O)c1nn(CCCCCF)c2ccccc12)C(C)C	C20H28FN3O3	cannabinoid
+COC(=O)[C@@H](OC(=O)c1nn(CC2CCCCC2)c2ccccc12)C(C)(C)C	C22H30N2O4	cannabinoid
+CCCCCn1cc(C(=O)NC23CC4CC(CC(C4)C2)C3)c(=O)c2cccc(OC)c21	C26H34N2O3	cannabinoid
+CC1(C)C(C(=O)c2cn(Cc3ccc(F)cc3)c3ccccc23)C1(C)C	C23H24FNO	cannabinoid
+CCCCCn1c2ccccc2c2cc(C(=O)c3cccc4ccccc34)ccc21	C28H25NO	cannabinoid
+O=C(c1ccc2c(c1)c1ccccc1n2CCCCCF)c1cccc2ccccc12	C28H24FNO	cannabinoid
+CCCCCCN1C(=O)/C(=N\NC(=O)c2ccccc2)c2ccccc21	C21H23N3O2	cannabinoid
+CCCCCN1C(=O)/C(=N\NC(=O)c2ccccc2)c2ccc(OC)cc21	C21H23N3O3	cannabinoid
+COc1ccccc1CC(=O)c1cn(CCC2CCCCC2)c2ccccc12	C25H29NO2	cannabinoid
+CCCCCn1cc(C(=O)NCc2ccccc2)c2ccccc21	C21H24N2O	cannabinoid
+O=C(NCc1ccccc1)c1cn(CCCCCF)c2ccccc12	C21H23FN2O	cannabinoid
+Cc1c(C(=O)c2cccc3ccccc23)c2cccc3c2n1[C@@H](CN1CCOCC1)CO3	C27H26N2O3	cannabinoid
+Cc1c(C(=O)c2ccccc2)c(N)c(-c2ccccc2)n1Cc1ccc(Cl)cc1	C25H21ClN2O	cannabinoid
+Cc1ccc(Nc2nc3ccc(C)cc3c(=O)o2)cc1	C16H14N2O2	cannabinoid
+CCCCNC(=O)Oc1ccc(OCc2ccccc2)cc1	C18H21NO3	cannabinoid
+NC(=O)c1cccc(-c2cccc(OC(=O)NC3CCCCC3)c2)c1	C20H22N2O3	cannabinoid
+O=C(Nc1cccc(-c2ccccc2)c1)OC1CCCCC1	C19H21NO2	cannabinoid
+NC(=O)c1cccc(-c2cc(OC(=O)NC3CCCCC3)ccc2O)c1	C20H22N2O4	cannabinoid
+COc1ccc(-c2oc3cc(OC)ccc3c2C(=O)c2ccc(C#N)cc2)cc1	C24H17NO4	cannabinoid
+CN(C)C(=O)n1nnnc1Cc1ccc(-c2ccccc2)cc1	C17H17N5O	cannabinoid
+O=C(Oc1ccc([N+](=O)[O-])cc1)N1CCC(C(O)(c2ccc3c(c2)OCO3)c2ccc3c(c2)OCO3)CC1	C27H24N2O9	cannabinoid
+O=C(Oc1ccc([N+](=O)[O-])cc1)N1CCN(Cc2cccc(Oc3ccccc3)c2)CC1	C24H23N3O5	cannabinoid
+CCCCCC1=CC(=O)C2=C(OC(C)(C)[C@@H]3CC=C(C)C[C@@H]23)C1=O	C21H28O3	cannabinoid
+CCCCCC1=CC(=O)C2=C(OC(C)(C)c3ccc(C)cc32)C1=O	C21H24O3	cannabinoid
+CCCCCCC(C)(C)c1cc(O)c2c(c1)OC(C)(C)c1cn(CC)nc1-2	C23H34N2O2	cannabinoid
+CCCCCCC(C)(C)c1cc(OC)c2c(c1)OC(C)(C)[C@@H]1CC=C(C)C[C@@H]21	C26H40O2	cannabinoid
+C=C1CC[C@@H]2[C@@H](C1)c1c(OC)cc(C(C)(C)CCCCCC)cc1OC2(C)C	C26H40O2	cannabinoid
+CC1=CC[C@@H]2[C@@H](C1)c1c(OC(=O)CCCN3CCOCC3)cc(C(C)(C)CCCCC#N)cc1OC2(C)C	C32H46N2O4	cannabinoid
+CC1=CC[C@@H]2[C@@H](C1)c1c(O)cc(CC#CCCCNS(C)(=O)=O)cc1OC2(C)C	C23H31NO4S	cannabinoid
+CC1=CC[C@@H]2[C@@H](C1)c1c(O)cc(CCCCCN(C)C)cc1OC2(C)C	C23H35NO2	cannabinoid
+CC1=CC[C@@H]2[C@@H](C1)c1c(O)cc(C(C)(C)CCCCn3ccnc3)cc1OC2(C)C	C26H36N2O2	cannabinoid
+CC1=CC[C@@H]2[C@@H](C1)c1c(O)cc(C(C)(C)CCCCC(=O)N3CCOCC3)cc1OC2(C)C	C28H41NO4	cannabinoid
+CCS(=O)(=O)NCCCCC(C)(C)c1cc(O)c2c(c1)OC(C)(C)[C@@H]1CC=C(C)C[C@@H]21	C25H39NO4S	cannabinoid
+CC1=CC[C@@H]2[C@@H](C1)c1c(O)cc(CC#CCCCC#N)cc1OC2(C)C	C23H27NO2	cannabinoid
+CC1=CC[C@@H]2[C@@H](C1)c1c(O)cc(C(C)(C)CCCCC(=O)N(C)C)cc1OC2(C)C	C26H39NO3	cannabinoid
+CC1=CC[C@@H]2[C@@H](C1)c1c(O)cc(C(C)(C)CCCCC(=O)N3CCCCC3)cc1OC2(C)C	C29H43NO3	cannabinoid
+CCC(C(=O)c1ccccc1)N(C)CC	C13H19NO	unknown
+COCC(=O)N(c1ccccc1F)C1CCN(CCc2ccccc2)CC1	C22H27FN2O2	fentanyl
+CC(=O)C(C#N)c1ccccc1	C10H9NO	unknown
+CC(=O)C(C(N)=O)c1ccccc1	C10H11NO2	unknown
+CCCCCCC(C)(C)c1ccc([C@@H]2C[C@H](O)CC[C@H]2CCCO)cc1	C24H40O2	cannabinoid
+CCCCCC(C)(C)c1ccc([C@@H]2C[C@H](O)CC[C@H]2CCCO)cc1	C23H38O2	cannabinoid
+CCCCCCC(C)(C)c1ccc([C@@H]2C[C@H](O)CC[C@H]2C)c(O)c1	C22H36O2	cannabinoid
+CCCCCCC(C)(C)c1ccc([C@@H]2C[C@H](O)CC[C@H]2CO)c(O)c1	C22H36O3	cannabinoid
+CCCCCCC(C)(C)c1ccc([C@@H]2C[C@H](O)CC[C@H]2CCO)c(O)c1	C23H38O3	cannabinoid
+CCCCCCC(C)(C)c1ccc([C@@H]2C[C@H](O)CC[C@H]2CCCCO)c(O)c1	C25H42O3	cannabinoid
+CCCCCCC(C)(C)c1ccc([C@@H]2C[C@H](O)CC[C@H]2CCCCCO)c(O)c1	C26H44O3	cannabinoid
+CCCCCCC(C)(C)c1ccc([C@@H]2C[C@H](O)CC[C@H]2CCCOC)c(O)c1	C25H42O3	cannabinoid
+CCCCCCC(C)(C)c1ccc([C@@H]2C[C@H](O)CC[C@H]2CC(C)O)c(O)c1	C24H40O3	cannabinoid
+CCCCCCC(C)(C)c1ccc([C@@H]2CCCC[C@H]2CCCO)c(O)c1	C24H40O2	cannabinoid
+CCCCCCC(C)(C)c1ccc(C2C[C@H](O)CCC[C@H]2CCCO)c(O)c1	C25H42O3	cannabinoid
+CCCCCCC(C)(C)c1ccc(C2C[C@H](NC(C)=O)CCC[C@H]2CCCO)c(O)c1	C27H45NO3	cannabinoid
+CCCCCCC(C)(C)c1ccc([C@@H]2CC(=O)CC[C@H]2CCCO)c(O)c1	C24H38O3	cannabinoid
+CCCCCC[C@H](C)Oc1ccc([C@@H]2C[C@H](O)CC[C@H]2CCCO)c(O)c1	C23H38O4	cannabinoid
+C[C@@H](CCCc1ccccc1)Oc1ccc(C2C[C@H](O)CCC[C@H]2CCCO)c(O)c1	C27H38O4	cannabinoid
+CCCCCCC(C)(C)c1ccc([C@@H]2C[C@H](O)C[C@H](CO)C2)c(O)c1	C22H36O3	cannabinoid
+CCCCCCC(C)(C)c1ccc([C@H]2C[C@@H](O)C[C@H]3CC[C@@H](CO)C[C@@H]32)c(O)c1	C26H42O3	cannabinoid
+CCCCCCC(C)(C)c1ccc(-c2cc(C)ccc2C(C)C)c(O)c1	C25H36O	cannabinoid
+CCCCCCC(C)(C)c1ccc(-c2cc(CO)ccc2C(C)C)c(O)c1	C25H36O2	cannabinoid
+CCCCCCC(C)(C)c1cc(O)c(C2CCCC2)c(O)c1	C20H32O2	cannabinoid
+CCCCCCC(C)(C)c1cc(O)c(C2CCCCC2)c(O)c1	C21H34O2	cannabinoid
+CCCCCCC(C)(C)c1cc(O)c(C2CCC[C@H](C)C2)c(O)c1	C22H36O2	cannabinoid
+CCCCCCC(C)(C)c1cc(O)c(C2CCCC(C)(C)C2)c(O)c1	C23H38O2	cannabinoid
+CCCCCCC(C)(C)c1cc(O)c(C2CCCCC2C)c(O)c1	C22H36O2	cannabinoid
+CCCCCCC(C)(C)c1cc(O)c(C2CCC(c3ccccc3)CC2)c(O)c1	C27H38O2	cannabinoid
+CCCCCCC(C)(C)c1cc(O)c(C2CCSCC2)c(O)c1	C20H32O2S	cannabinoid
+CCCCCCC(C)(C)c1cc(OC)c(C2(O)CCCC(C)C2)c(OC)c1	C24H40O3	cannabinoid
+CCCCCCC(C)(C)c1cc(O)c(C2CCCCCC2)c(O)c1	C22H36O2	cannabinoid
+CCCCCCC(C)(C)c1cc(O)c(C2C3CC4CC(C3)CC2C4)c(O)c1	C25H38O2	cannabinoid
+CCCCCCC(C)(C)c1cc(O)c(-c2cc(Cl)cc(Cl)c2)c(O)c1	C21H26Cl2O2	cannabinoid
+CCCCCCC(C)(C)c1cc(O)c(-c2cc(C)ccc2F)c(O)c1	C22H29FO2	cannabinoid
+CCCCCCC(C)(C)c1cc(O)c(-c2cncc(C(=O)OCC)c2)c(O)c1	C23H31NO4	cannabinoid
+CCCCCCC(C)(C)c1cc(O)c(-c2cc(O)ccc2CCCO)c(O)c1	C24H34O4	cannabinoid
+CCCCCCC(C)(C)c1cc(O)c(-c2cc(C)cc(C)c2)c(O)c1	C23H32O2	cannabinoid
+CCCCCCC(C)(C)c1ccc(-c2cc(C)cc(C)c2)c(O)c1	C23H32O	cannabinoid
+CCCCCCC(C)(C)c1ccc([C@H]2C[C@@H](O)CC[C@@H]2CCCO)c(O)c1	C24H40O3	cannabinoid
+CCCCCCC(C)(C)c1cc(O)c2c(c1)OC(C)(C)[C@@H]1CCC(C)=C[C@@H]21	C25H38O2	cannabinoid
+CCCCCCC(C)(C)c1cc(N)c2c(c1)OC(C)(C)[C@@H]1CCC(C)=C[C@@H]21	C25H39NO	cannabinoid
+CCCCCc1cc(N)c2c(c1)OC(C)(C)[C@@H]1CCC(C)=C[C@@H]21	C21H31NO	cannabinoid
+CCCCCCC(C)(C)c1cc(C#N)c2c(c1)OC(C)(C)[C@@H]1CCC(C)=C[C@@H]21	C26H37NO	cannabinoid
+CCCCCCC(C)(C)c1cc(O)c2c(c1)OC(C)(C)c1ccc(CO)cc1-2	C25H34O3	cannabinoid
+CCCCCCC(C)(C)c1cc(O)c2c(c1)OC(C)(C)c1ccc(C(=O)O)cc1-2	C25H32O4	cannabinoid
+CCCCCC(C)C(C)c1cc(O)c2c(c1)OC(C)(C)C1=C2CN(C)CC1	C24H37NO2	cannabinoid
+CCCCCCC(C)(C)c1cc(O)c2c(c1)O[C@@](C)(CCCO)[C@@H]1CC[C@@H](CO)C[C@@H]21	C27H44O4	cannabinoid
+CCCCCC(C)C(C)c1cc(O)c2c(c1)OC(C)(C)C1=C2C2CCN1CC2	C25H37NO2	cannabinoid
+CCCCCc1cc(O)c2c(c1)OC(C)(C)[C@@H]1CCC(C)N(C)[C@@H]21	C21H33NO2	cannabinoid
+CCCCCC(C)C(C)c1cc(O)c(C2=C(C(C)C)CCC(C)C2)c(O)c1	C25H40O2	cannabinoid
+CCCCCCC1CCCc2c1cc1c(c2O)[C@@H]2CC(C)=CC[C@H]2C(C)(C)O1	C26H38O2	cannabinoid
+CCCCCC(C)C(C)c1cc(O)c2c(c1)OCC1=C2CC(C)CC1	C23H34O2	cannabinoid
+CCCCCCC(C)(C)c1cc(O)c2c(c1)O[C@@](C)(/C=C/CO)[C@@H]1CC[C@@H](CO)C[C@@H]21	C27H42O4	cannabinoid
+CCCCCCC(C)(C)c1cc(O)c2c(c1)O[C@@](C)(C#CCO)[C@@H]1CC[C@@H](CO)C[C@@H]21	C27H40O4	cannabinoid
+CC(C)(C)[C@@H](CO)NC(=O)c1nn(-c2c[n+]([O-])ccn2)c2c1C[C@@H]1C[C@H]21	C18H23N5O3	cannabinoid
+CNC(=O)[C@@H](NC(=O)c1nn(-c2ccc(F)cc2F)c2c1C[C@H]1C[C@@H]21)C(C)(C)C	C21H24F2N4O2	cannabinoid
+O=C(NC1(CO)CCOCC1)c1nn(-c2ccc(F)cc2F)c2c1C[C@H]1C[C@@H]21	C20H21F2N3O3	cannabinoid
+CC(C)(CO)NC(=O)c1nn(-c2ccc(F)cc2F)c2c1C[C@H]1C[C@@H]21	C18H19F2N3O2	cannabinoid
+CNC(=O)[C@@H](NC(=O)c1nn(-c2cnccn2)c2c1C[C@H]1C[C@@H]21)C(C)(C)C	C19H24N6O2	cannabinoid
+O=C(N[C@H]1c2ccccc2C[C@H]1O)c1nn(-c2c[n+]([O-])ccn2)c2c1C[C@@H]1C[C@H]21	C21H19N5O3	cannabinoid
+CC(C)(NC(=O)c1nn(-c2cnccn2)c2c1C[C@@H]1C[C@H]21)C(F)(F)F	C16H16F3N5O	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1nn(Cc2ccc(F)cc2)c2c(Cl)cccc12)C(=O)NCCNS(=O)(=O)C1CC1	C26H31ClFN5O4S	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1nn(Cc2ccc(F)cc2)c2ccccc12)C(=O)NCc1nnc(C(N)=O)o1	C25H26FN7O4	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1nn(Cc2ccccc2)c2cc(Br)ccc12)C(N)=O	C21H23BrN4O2	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1nn(Cc2ccc(F)cc2)c2ccccc12)C(=O)NCCO	C23H27FN4O3	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1nn(Cc2ccc(F)cc2)c2ccccc12)C(=O)NCCNS(=O)(=O)C1CC1	C26H32FN5O4S	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1nn(Cc2ccc(F)cc2)c2ccc(F)cc12)C(N)=O	C21H22F2N4O2	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1nn(Cc2ccc(F)cc2)c2ccc(F)cc12)C(=O)NC1CC1	C24H26F2N4O2	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1nn(Cc2ccc(F)cc2)c2ccc(F)cc12)C(=O)NCCO	C23H26F2N4O3	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1nn(Cc2ccc(F)cc2)c2c(F)cccc12)C(N)=O	C21H22F2N4O2	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1nn(Cc2ccc(F)cc2)c2c(F)cccc12)C(=O)NC1CC1	C24H26F2N4O2	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1nn(Cc2ccc(F)cc2)c2c(F)cccc12)C(=O)NCCO	C23H26F2N4O3	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1nn(Cc2ccc(F)cc2)c2c(Cl)cccc12)C(N)=O	C21H22ClFN4O2	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1nn(Cc2ccc(F)cc2)c2c(Cl)cccc12)C(=O)NCCO	C23H26ClFN4O3	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1nn(Cc2ccc(F)cc2)c2c(Cl)cc(Cl)cc12)C(N)=O	C21H21Cl2FN4O2	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1nn(Cc2ccc(F)cc2)c2ccccc12)C(=O)N1C[C@@H](O)[C@H](O)C1	C25H29FN4O4	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1nn(Cc2ccc(F)cc2)c2c(F)c(F)ccc12)C(N)=O	C21H21F3N4O2	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1nn(Cc2ccc(F)cc2)c2ccccc12)C(=O)N1CC(F)(F)C1	C24H25F3N4O2	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1nn(Cc2ccc(F)cc2)c2ccccc12)C(=O)N1CC(F)C1	C24H26F2N4O2	cannabinoid
+CNC(=O)[C@@H](NC(=O)c1nn(CC2CCCCC2)c2ccccc12)C(C)(C)C	C22H32N4O2	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1nn(CC2CCCCC2)c2ccc(F)cc12)C(=O)NCC(N)=O	C23H32FN5O3	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1nn(CC2CCCCC2)c2c(F)cccc12)C(=O)NCCCO	C24H35FN4O3	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1nn(CCCC#N)c2ccccc12)c1nnc(N)o1	C19H23N7O2	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1nn(CC2CCCCC2)c2cc(F)ccc12)C(=O)NCCCO	C24H35FN4O3	cannabinoid
+CCOC(=O)c1nnc(CNC(=O)[C@@H](NC(=O)c2nn(CC3CCOCC3)c3ccccc23)C(C)(C)C)o1	C26H34N6O6	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1nn(CC2CCCCC2)c2ccccc12)C(=O)NCc1nnc(C(N)=O)o1	C25H33N7O4	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1nn(CCCCC#N)c2ccccc12)C(=O)NCC1(O)CCOCC1	C25H35N5O4	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1nn(CCCCC(F)(F)F)c2ccccc12)C(N)=O	C19H25F3N4O2	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1nn(CC(=O)c2ccc(OC(F)(F)F)cc2)c2ccccc12)C(=O)NCC(N)=O	C25H26F3N5O5	cannabinoid
+CN(C(=O)Cn1nc(C(=O)N[C@H](C(=O)NCCO)C(C)(C)C)c2ccccc21)C1CCCCC1	C25H37N5O4	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1nn(CC2CCOCC2)c2ccccc12)C(=O)NCc1noc(C(N)=O)n1	C24H31N7O5	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1nn(CC2CCC(F)(F)CC2)c2c(Cl)cccc12)C(N)=O	C21H27ClF2N4O2	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1nn(CC2CCSCC2)c2ccccc12)C(N)=O	C20H28N4O2S	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1nn(CCCCC#N)c2c(F)cccc12)C(=O)NCC(F)(F)F	C21H25F4N5O2	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1nn(CC2CC3CCC2C3)c2ccccc12)C(N)=O	C22H30N4O2	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1nn(CC2CC(F)(F)C2)c2c(F)cccc12)C(N)=O	C19H23F3N4O2	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1nn(CCCC(F)(F)F)c2c(F)cccc12)C(N)=O	C18H22F4N4O2	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1nn(CCOCC(F)(F)F)c2c(F)cccc12)C(N)=O	C18H22F4N4O3	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1nn(CCCCC(F)(F)F)c2c(F)cccc12)C(N)=O	C19H24F4N4O2	cannabinoid
+CC(C)(C)CCn1nc(C(=O)N[C@H](C(N)=O)C(C)(C)C)c2cccc(F)c21	C20H29FN4O2	cannabinoid
+C=C(C)[C@@H]1CCC(C)=C[C@H]1c1c(O)cc(CCCCC)cc1O	C21H30O2	cannabinoid
+C=C(C)[C@@H]1CC=C(C)C[C@H]1c1c(O)cc(CCCCC)cc1O	C21H30O2	cannabinoid
+C=C(C)C1=C(c2c(O)cc(CCCCC)cc2O)CC(C)CC1	C21H30O2	cannabinoid
+C=C(C)[C@@H]1CCC(C)=C[C@H]1c1c(O)cc(CCC)cc1O	C19H26O2	cannabinoid
+C=C(C)[C@@H]1CCC(C)=C[C@H]1c1c(O)cc(CCCC)cc1O	C20H28O2	cannabinoid
+C=C(C)[C@@H]1CCC(C)=C[C@H]1c1c(O)cc(CCCCCCC)cc1O	C23H34O2	cannabinoid
+C=C(C)[C@H]1CCC(C)=C[C@@H]1c1c(O)cc(CCCCC)cc1O	C21H30O2	cannabinoid
+C=C(C)[C@@H]1CCC(C)=C[C@H]1c1c(O)cc(CCCCC)c(C(=O)O)c1O	C22H30O4	cannabinoid
+C=C(C)[C@H]1CCC(C)=C[C@H]1c1c(O)cc(CCCCC)cc1O	C21H30O2	cannabinoid
+C=C(C)[C@@H]1CCC(C)=C[C@H]1c1c(O)cc(O)cc1CCCCC	C21H30O2	cannabinoid
+C=C(C)[C@@H]1CCC(C)=C[C@H]1c1c(O)cc(C)cc1O	C17H22O2	cannabinoid
+C=C(C)[C@@H]1CCC(C)=C[C@H]1c1c(C)cc(O)cc1O	C17H22O2	cannabinoid
+C=C(C)[C@@H]1CCC(C)=C[C@H]1c1c(OC)cc(C)cc1OC	C19H26O2	cannabinoid
+C=C(C)c1ccc(C)cc1-c1c(O)cc(CCCCC)cc1O	C21H26O2	cannabinoid
+C=C(C)[C@@H]1CCC(C)=C[C@H]1c1c(O)cc(C(C)(C)CCCCCC)cc1O	C25H38O2	cannabinoid
+C=C(C)[C@@H]1CCC(C)=C[C@H]1c1c(O)cc(C(C)C(C)CCCCC)cc1O	C25H38O2	cannabinoid
+C=C(C)[C@H]1CCC(C)=C[C@@H]1c1c(O)cc(C(C)(C)CCCCCC)cc1O	C25H38O2	cannabinoid
+C=C(C)[C@@H]1CCC(CO)=C[C@H]1c1c(O)cc(CCCCC)cc1O	C21H30O3	cannabinoid
+C=C(C)[C@@H]1CCC(C(=O)O)=C[C@H]1c1c(O)cc(CCCCC)cc1O	C21H28O4	cannabinoid
+C=C(C)[C@H]1CCC(CO)=C[C@@H]1c1c(O)cc(CCCCC)cc1O	C21H30O3	cannabinoid
+C=C(C)[C@H]1CCC(C(=O)O)=C[C@@H]1c1c(O)cc(CCCCC)cc1O	C21H28O4	cannabinoid
+C=C(C)[C@@H]1CCC(CO)=C[C@H]1c1c(O)cc(C(C)(C)CCCCCC)cc1O	C25H38O3	cannabinoid
+C=C(C)[C@@H]1CCC(C(=O)O)=C[C@H]1c1c(O)cc(C(C)(C)CCCCCC)cc1O	C25H36O4	cannabinoid
+C=C(C)[C@H]1CCC(CO)=C[C@@H]1c1c(O)cc(C(C)(C)CCCCCC)cc1O	C25H38O3	cannabinoid
+C=C(C)[C@H]1CCC(C(=O)O)=C[C@@H]1c1c(O)cc(C(C)(C)CCCCCC)cc1O	C25H36O4	cannabinoid
+C=C(C)[C@@H]1CCC(C)=C[C@H]1c1c(O)cc(CCCCC)c(F)c1O	C21H29FO2	cannabinoid
+CCCCCCC1(c2ccc(-c3cc(C)cc(C)c3)c(O)c2)CCCC1	C25H34O	cannabinoid
+CCCCCCC1(c2ccc(-c3cc(C)cc(C)c3)c(O)c2)CCCCC1	C26H36O	cannabinoid
+COC(=O)CCCCC(C)(C)c1ccc(-c2cc(C)cc(C)c2)c(O)c1	C23H30O3	cannabinoid
+CCCCCCC(C)(C)c1ccc(-c2c(C)cccc2C)c(O)c1	C23H32O	cannabinoid
+CCCCCCC(C)(C)c1ccc(-c2cc(C)ccc2C)c(O)c1	C23H32O	cannabinoid
+CCCCCCC(C)(C)c1ccc(-c2ccccc2OC)c(O)c1	C22H30O2	cannabinoid
+C=C(C)[C@@H]1CCC(C)=C[C@H]1C1=C(O)C(=O)C(CCCCC)=CC1=O	C21H28O3	cannabinoid
+CCCCCCC(C)(C)c1cc(OC)c([C@H]2C=C(CO)C3CC2C3(C)C)c(OC)c1	C27H42O3	cannabinoid
+CCCCCCCC(C)(C)c1ccc(C2C[C@H](O)CC(C)(C)C2)c(O)c1	C24H40O2	cannabinoid
+CC1=C[C@H](c2ccc(C3(CCCCCC#N)CCCC3)cc2O)C2CC1C2(C)C	C27H37NO	cannabinoid
+C=C(C)[C@@H]1CC[C@@H](CO)C[C@H]1c1c(O)cc(C23CC4CC(CC(C4)C2)C3)cc1O	C26H36O3	cannabinoid
+CCCCCCC(C)(C)c1cc(O)c2c(c1)O[C@@H]1CC(C)(C)CC[C@H]21	C23H36O2	cannabinoid
+CCCCCc1cc(O)c2c(c1)O[C@]1(C(C)C)CC[C@H](C)[C@@H]2C1	C21H32O2	cannabinoid
+CCCCCc1cc(O)c2c(c1)O[C@@](C)(CO)[C@@H]1CCC(C)=C[C@@H]21	C21H30O3	cannabinoid
+CCCCCc1cc2c(c(O)c1C)[C@@H]1C=C(C)CC[C@H]1C(C)(C)O2	C22H32O2	cannabinoid
+CCCCOC(=O)[C@@H](C)c1cc(O)c2c(c1)OC(C)(C)[C@@H]1CC=C(C)C[C@@H]21	C23H32O4	cannabinoid
+CCCCOC(=O)C(C)(C)c1cc(O)c2c(c1)OC(C)(C)[C@@H]1CC=C(C)C[C@@H]21	C24H34O4	cannabinoid
+CCCCOC(=O)C1(c2cc(O)c3c(c2)OC(C)(C)[C@@H]2CC=C(C)C[C@@H]32)CCC1	C25H34O4	cannabinoid
+CC1=CC[C@@H]2[C@@H](C1)c1c(O)cc(C(C)(C)C(=O)OCCCCC#N)cc1OC2(C)C	C25H33NO4	cannabinoid
+CC1=CC[C@@H]2[C@@H](C1)c1c(O)cc(C(C)(C)C(=O)OCCCC#N)cc1OC2(C)C	C24H31NO4	cannabinoid
+CC1=CC[C@@H]2[C@@H](C1)c1c(O)cc(C(C)(C)C(=O)OCCCn3ccnc3)cc1OC2(C)C	C26H34N2O4	cannabinoid
+CC1=CC[C@@H]2[C@@H](C1)c1c(O)cc(C3(C(=O)OCCCCC#N)CCC3)cc1OC2(C)C	C26H33NO4	cannabinoid
+CC(C)(C(=O)OCCCN1CCOCC1)c1cc(O)c2c(c1)OC(C)(C)[C@@H]1CC=C(CO)C[C@@H]21	C27H39NO6	cannabinoid
+CCCSC(=O)C(C)(C)c1cc(O)c2c(c1)OC(C)(C)[C@@H]1CC=C(C)C[C@@H]21	C23H32O3S	cannabinoid
+CCCCCNC(=O)C(C)(C)c1cc(O)c2c(c1)OC(C)(C)[C@@H]1CC=C(C)C[C@@H]21	C25H37NO3	cannabinoid
+CCCCC(=O)OCC(C)(C)c1cc(O)c2c(c1)OC(C)(C)[C@@H]1CC=C(C)C[C@@H]21	C25H36O4	cannabinoid
+CCCCOC(=O)C(C)(C)c1cc(O)c2c(c1)OC(C)(C)[C@@H]1CC=C(CO)C[C@@H]21	C24H34O5	cannabinoid
+CC(C)(C(=O)OCCCC#N)c1cc(O)c2c(c1)OC(C)(C)[C@@H]1CC=C(CO)C[C@@H]21	C24H31NO5	cannabinoid
+CCCCOC(=O)C(C)(C)c1cc(O)c2c(c1)OC(C)(C)[C@@H]1CCC(=O)C[C@@H]21	C23H32O5	cannabinoid
+CCCCOC(=O)C(C)(C)c1cc(O)c2c(c1)OC(C)(C)[C@@H]1CC[C@@H](O)C[C@@H]21	C23H34O5	cannabinoid
+CCCCOC(=O)C(C)(C)c1cc(O)c2c(c1)OC(C)(C)[C@@H]1CC[C@@H](CO)C[C@@H]21	C24H36O5	cannabinoid
+CC1=CC[C@@H]2[C@@H](C1)c1c(O)cc(CCCCCF)cc1OC2(C)C	C21H29FO2	cannabinoid
+CC1=CC[C@@H]2[C@@H](C1)c1c(O)cc(CCCCCBr)cc1OC2(C)C	C21H29BrO2	cannabinoid
+CC(=O)Oc1cc(O[C@H](C)CCCc2ccccc2)cc2c1[C@@H]1C[C@H](O)CC[C@H]1[C@H](C)N2	C27H35NO4	cannabinoid
+C[C@H](CCCc1ccccc1)Oc1cc(O)c2c(c1)N[C@@H](C)[C@@H]1CC[C@@H](O)C[C@@H]21	C25H33NO3	cannabinoid
+CC(=O)Oc1cc(O[C@H](C)CCCc2ccccc2)cc2c1[C@@H]1C[C@H](O)CC[C@H]1[C@H](C)N2C	C28H37NO4	cannabinoid
+CCCCC[C@@H](C)Oc1cc(O)c2c(c1)N[C@@H](C)[C@@H]1CC[C@@H](O)C[C@@H]21	C21H33NO3	cannabinoid
+CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)NCCO	C22H37NO2	cannabinoid
+CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)OC(CO)CO	C23H38O4	cannabinoid
+CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCOC(CO)CO	C23H40O3	cannabinoid
+CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)N[C@H](C)CO	C23H39NO2	cannabinoid
+CCCCC/C=C\C/C=C\C/C=C\C/C=C\CC[C@@H](C)C(=O)N[C@H](C)CO	C24H41NO2	cannabinoid
+CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)NCC(=O)O	C22H35NO3	cannabinoid
+CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)OCCN	C22H37NO2	cannabinoid
+CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)NCCc1ccc(O)c(O)c1	C28H41NO3	cannabinoid
+CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)NCCc1c[nH]c2ccc(O)cc12	C30H42N2O2	unknown
+CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)NCCCl	C22H36ClNO	cannabinoid
+CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)NC1CC1	C23H37NO	cannabinoid
+CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)Nc1ccc(O)cc1	C26H37NO2	cannabinoid
+CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCNC(=O)c1ccc(O)cc1	C27H39NO2	cannabinoid
+CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)Nc1ccc(O)cc1C	C27H39NO2	cannabinoid
+CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)Nc1ccccc1O	C26H37NO2	cannabinoid
+C=CCNC(=O)CCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC	C23H37NO	cannabinoid
+CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)C(F)(F)F	C21H31F3O	cannabinoid
+CCCCCC(C)(C)/C=C\C/C=C\C/C=C\C/C=C\CCC(C)C(=O)NCCF	C26H44FNO	cannabinoid
+C[C@H](CO)NC(=O)CCC/C=C\C/C=C\C/C=C\C/C=C\C(C)(C)CCCCC#N	C26H42N2O2	cannabinoid
+O=C(NCC1CC1)c1nn(CCCCCF)c2ccccc12	C17H22FN3O	cannabinoid
+O=C(NCC1CC1)c1cn(CCCCCF)c2ccccc12	C18H23FN2O	cannabinoid
+CCCC(F)Cn1nc(C(=O)N[C@H](C(N)=O)C(C)C)c2ccccc21	C18H25FN4O2	cannabinoid
+CCOC(=O)[C@@H](NC(=O)c1nn(Cc2ccc(F)cc2)c2ccccc12)C(C)C	C22H24FN3O3	cannabinoid
+CCOC(=O)[C@@H](NC(=O)c1cn(CCCCCF)c2ccccc12)C(C)C	C21H29FN2O3	cannabinoid
+CC(C)[C@H](NC(=O)c1cn(Cc2ccccc2)c2ccccc12)C(N)=O	C21H23N3O2	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1nn(Cc2ccccc2)c2ccccc12)C(N)=O	C21H24N4O2	cannabinoid
+CC(C)[C@H](NC(=O)c1nn(CCCCCCl)c2ccccc12)C(N)=O	C18H25ClN4O2	cannabinoid
+C/C(=C\C(=O)c1cn(CCN2CCOCC2)c2ccccc12)C(C)(C)C	C22H30N2O2	cannabinoid
+CCCCCCC(NC)C(=O)c1ccccc1	C15H23NO	beta-ketone
+CC(C)[C@H](NC(=O)c1nn(Cc2ccccc2F)c2ccccc12)C(N)=O	C20H21FN4O2	cannabinoid
+CCC(C)[C@H](NC(=O)c1nn(CCCCCF)c2ccccc12)C(=O)OC	C20H28FN3O3	cannabinoid
+O=C(NCC1CCCC1)c1nn(CCCCCF)c2ccccc12	C19H26FN3O	cannabinoid
+O=C(NCC1CCCO1)c1nn(CCCCCF)c2ccccc12	C18H24FN3O2	cannabinoid
+CCCCCn1cc(C(=O)Nc2c(C)cccc2C)c2ccccc21	C22H26N2O	cannabinoid
+C=CCCCn1nc(C(=O)N[C@H](C(N)=O)C(C)C)c2ccccc21	C18H24N4O2	cannabinoid
+C=CCCCCn1nc(C(=O)N[C@H](C(N)=O)C(C)C)c2ccccc21	C19H26N4O2	cannabinoid
+CC(C)[C@H](NC(=O)c1nn(CCCCCCF)c2ccccc12)C(N)=O	C19H27FN4O2	cannabinoid
+CCCCCn1cc(C(=O)CC(C)(C)C(C)(C)O)c2ccccc21	C21H31NO2	cannabinoid
+CC1(C)C(C(=O)c2cn(CC3CCOCC3)c3c(F)c(F)c(F)c(F)c23)C1(C)C	C22H25F4NO2	cannabinoid
+CC1(C)C(C(=O)c2cn(CC3CCOCC3)c3cc(Cl)ccc23)C1(C)C	C22H28ClNO2	cannabinoid
+CC1(C)C(C(=O)c2cn(CC3CCOCC3)c3cc(Br)ccc23)C1(C)C	C22H28BrNO2	cannabinoid
+Cc1ccc2c(C(=O)C3C(C)(C)C3(C)C)cn(CC3CCOCC3)c2c1	C23H31NO2	cannabinoid
+COc1ccc2c(C(=O)C3C(C)(C)C3(C)C)cn(CC3CCOCC3)c2c1	C23H31NO3	cannabinoid
+COc1cccc2c(C(=O)C3C(C)(C)C3(C)C)cn(CC3CCOCC3)c12	C23H31NO3	cannabinoid
+CC1(C)C(C(=O)c2cn(CC3CCOCC3)c3cc(OCc4ccccc4)ccc23)C1(C)C	C29H35NO3	cannabinoid
+CC1(C)C(C(=O)c2cn(CC3CCOCC3)c3cc4c(cc23)OCO4)C1(C)C	C23H29NO4	cannabinoid
+CC1(C)C(C(=O)c2cn(CC3CCOCC3)c3cc(C#N)ccc23)C1(C)C	C23H28N2O2	cannabinoid
+COC(=O)c1ccc2c(C(=O)C3C(C)(C)C3(C)C)cn(CC3CCOCC3)c2c1	C24H31NO4	cannabinoid
+COCCn1c(C)c(C)s/c1=N\C(=O)C12CC3CC(CC(C3)C1)C2	C19H28N2O2S	cannabinoid
+COCCn1c(C)c(C)s/c1=N\C(=O)c1cccc2ccccc12	C19H20N2O2S	cannabinoid
+COCCn1/c(=N/C(=O)C2C(C)(C)C2(C)C)sc2ccccc21	C18H24N2O2S	cannabinoid
+CCOc1ccccc1C(=O)/N=c1\sc(C)cn1CC1CCOCC1	C19H24N2O3S	cannabinoid
+CCCCn1c(C)c(C(C)(C)O)s/c1=N\C(=O)c1cc(Cl)ccc1OC	C19H25ClN2O3S	cannabinoid
+CC(C)(O)c1ccc(-c2nc(-c3ccc(F)cc3)oc2Sc2ccc(Cl)cn2)cc1	C23H18ClFN2O2S	cannabinoid
+O=C(Nc1cnccc1Cl)N1CCN(Cc2ccc3c(c2)OC(F)(F)O3)CC1	C18H17ClF2N4O3	cannabinoid
+O=C(Nc1cccnc1)N1CCC(Cc2cccc(Oc3ccc(C(F)(F)F)cn3)c2)CC1	C24H23F3N4O2	cannabinoid
+O=C(Nc1cccnn1)N1CCC(=Cc2cccc(Oc3ccc(C(F)(F)F)cn3)c2)CC1	C23H20F3N5O2	cannabinoid
+CCCCCCCC(C)(C)c1cc(O)c2cc(Cc3ccccc3O)c(=O)oc2c1	C26H32O4	cannabinoid
+CCCCCc1cc(OC)c2cc(Cc3ccccc3OC)c(=O)oc2c1	C23H26O4	cannabinoid
+CCCCCc1cc(O)c2c(c1)OC(C)(CCC=C(C)C)C=C2	C21H30O2	cannabinoid
+CCCCCc1cc(O)c(C/C=C(\C)CCC=C(C)C)c(O)c1	C21H32O2	cannabinoid
+C=C(C)[C@@H]1CC[C@](C)(O)[C@H]2Oc3cc(CCCCC)cc(O)c3[C@@H]12	C21H30O3	cannabinoid
+CCCCCc1cc(O)c2c(c1)O[C@]1(C)CC[C@H]3[C@@H]1[C@@H]2C3(C)C	C21H30O2	cannabinoid
+CCCCCc1cc(O)c2c(c1)OC(C)(C)C1=C2C(O)C(C)(O)CC1	C21H30O4	cannabinoid
+CCCCCc1cc(O)c2c(c1)OC(C)(C)[C@@H]1CC(O)C(C)=C[C@@H]21	C21H30O3	cannabinoid
+CCCCCc1cc(O)c2c(c1)OC(C)(C)[C@@H]1CC=C(C)C(O)[C@@H]21	C21H30O3	cannabinoid
+CCCCCc1cc(O)c2c(c1)OC(C)(C)[C@@H]1CC(O)C(CO)=C[C@@H]21	C21H30O4	cannabinoid
+CCCCCc1cc2c(c(O)c1Cc1c(CCCCC)cc3c(c1O)[C@@H]1C=C(C)CC[C@H]1C(C)(C)O3)[C@@H]1C=C(C)CC[C@H]1C(C)(C)O2	C43H60O4	cannabinoid
+CCCCCc1cc(O)c2c(c1)oc1c(C)ccc(C(C)C)c12	C21H26O2	cannabinoid
+CCCCCc1cc(O)c2c(c1)OC(C)(C)[C@@H]1CC[C@](C)(O)[C@@H](O)[C@@H]21	C21H32O4	cannabinoid
+CCCCCc1cc2c3c(coc3c1)C(CCC(C)=O)C(C)(C)O2	C21H28O3	cannabinoid
+CCCCCc1cc2c3c(c1)O[C@]1(C)CC[C@H]([C@@H]3C1)C(C)(C)O2	C21H30O2	cannabinoid
+CCCCCc1cc(O)c2c(c1)OC(C)(C)[C@]1(O)C(O)CC(C)=C[C@@]21O	C21H30O5	cannabinoid
+C=C1COc2cc(CCCCC)cc3oc4c(C)ccc1c4c23	C21H22O2	cannabinoid
+C=C(C)[C@@H]1C[C@@H](C(C)=O)[C@H](O)C1c1c(O)cc(CCCCC)cc1O	C21H30O4	cannabinoid
+C=C1CC/C=C(\C)CC[C@@H]2[C@@H]1CC2(C)C	C15H24	cannabinoid
+NCCc1cc(O)c(O)cc1F	C8H10FNO2	unknown
+COc1cc(CCCc2ccccc2)c(OC)c(CC(C)N)c1	C20H27NO2	unknown
+CC(N)Cc1cccc(CCCc2ccccc2)c1	C18H23N	unknown
+COc1cc(CC=O)cc(OC)c1OC	C11H14O4	unknown
+CN1CC(O)C2=CC(=O)C(=O)C=C21	C9H9NO3	unknown
+COc1cc(C(=O)O)cc(OC)c1OC	C10H12O5	unknown
+COc1cc(/C=C/[N+](=O)[O-])cc(OC)c1OC	C11H13NO5	unknown
+COc1cc(CC#N)cc(OC)c1OC	C11H13NO3	unknown
+COc1cc(C=O)cc(OC)c1O	C9H10O4	unknown
+COc1cc(C=O)cc(OC)c1OC(F)F	C10H10F2O4	unknown
+COc1cc(/C=C/[N+](=O)[O-])cc(OC)c1OC(F)F	C11H11F2NO5	unknown
+COc1cc(C=O)cc(OC)c1OC(F)(F)F	C10H9F3O4	unknown
+COc1cc(/C=C/[N+](=O)[O-])cc(OC)c1OC(F)(F)F	C11H10F3NO5	unknown
+C=COc1c(OC)cc(C=O)cc1OC	C11H12O4	unknown
+C=COc1c(OC)cc(/C=C/[N+](=O)[O-])cc1OC	C12H13NO5	unknown
+COc1cc(C=O)cc(O)c1OC	C9H10O4	unknown
+CNC(C)Cc1cc(O)c(O)c(SCC(NC(C)=O)C(=O)O)c1	C15H22N2O5S	unknown
+CNC(C)Cc1cc(O)c(O)c(SCC(NC(=O)CCC(N)C(=O)O)C(=O)NCC(=O)O)c1	C20H30N4O8S	unknown
+COc1cc(C=O)cc(F)c1O	C8H7FO3	unknown
+O=Cc1cc(O)c(O)c(F)c1	C7H5FO3	unknown
+O=Cc1cc(F)c2c(c1)OCO2	C8H5FO3	unknown
+C/C(=C\c1cc(F)c2c(c1)OCO2)[N+](=O)[O-]	C10H8FNO4	unknown
+CC(C)(C)NC(CO)c1cc(Cl)c(N)c(C(F)(F)F)c1	C13H18ClF3N2O	unknown
+CNC(Cc1cc(Br)c(OC)c(Br)c1)C(=O)NCCCOc1c(Br)cc(CCN(C)C)cc1Br	C24H31Br4N3O3	unknown
+COC1=C(Br)C[C@]2(OC=C1Br)ON=C(C(=O)NCCCOc1c(Br)cc(CCN)cc1Br)[C@@H]2O	C21H23Br4N3O6	unknown
+COc1cc(C(C)C)c(OC)cc1C=O	C12H16O3	unknown
+COc1cc(C(C)C)c(OC)cc1/C=C/[N+](=O)[O-]	C13H17NO4	unknown
+COc1cc(C(C)C)c(OC)cc1/C=C(\C)[N+](=O)[O-]	C14H19NO4	unknown
+C=Cc1cc(OC)c(CCNC(=O)OC(C)(C)C)cc1OC	C17H25NO4	unknown
+COc1cc(CCNC(=O)OC(C)(C)C)c(OC)cc1I	C15H22INO4	unknown
+COc1ccccc1C1(N2CCOCC2)CCCCC1	C17H25NO2	arylcycloalkylamine
+COc1ccc(C2(N3CCOCC3)CCCCC2)cc1	C17H25NO2	arylcycloalkylamine
+Cc1cccc(C2(N3CCOCC3)CCCCC2)c1	C17H25NO	arylcycloalkylamine
+CCCCCn1c(C(=O)c2cccc3ccccc23)nc2ccccc21	C23H22N2O	cannabinoid
+O=C(Nc1cccc2ccccc12)c1cn(Cc2ccc(F)cc2)c2ccccc12	C26H19FN2O	cannabinoid
+O=C(Oc1cccc2ccccc12)c1cn(CCCCCF)c2ccccc12	C24H22FNO2	cannabinoid
+CCCC(NC(C)C)C(=O)c1ccccc1	C14H21NO	unknown
+O=C(c1cccc2ccccc12)c1nn(CCCCCF)c2ccccc12	C23H21FN2O	cannabinoid
+C#CCN1CCC2=C(C1)c1c(OC(=O)CCCN3CCCCC3)cc(C(C)C(C)CCCCC)cc1OC2(C)C	C35H52N2O3	cannabinoid
+CCCCCC(C)C(C)c1cc(OC(=O)CCCN2CCCCCC2)c2c(c1)OC(C)(C)C1=C2CC(C)CC1	C35H55NO3	cannabinoid
+C#CCN1CCC2=C(C1)c1c(OC(=O)C(C)CCN3CCCCC3C)cc(C(C)C(C)CCCCC)cc1OC2(C)C	C37H56N2O3	cannabinoid
+CC1=CC[C@@H]2[C@@H](C1)c1c(O)cc(CC#CCCCBr)cc1OC2(C)C	C22H27BrO2	cannabinoid
+CC1=CC[C@@H]2[C@@H](C1)c1c(O)cc(C/C=C\CCCN=[N+]=[N-])cc1OC2(C)C	C22H29N3O2	cannabinoid
+CC1=CC[C@@H]2[C@@H](C1)c1c(OC(=O)CCCN(C(C)C)C(C)C)cc(C(C)(C)CCCCC(=O)N3CCOCC3)cc1OC2(C)C	C38H60N2O5	cannabinoid
+COc1ccc2c(c1)c(CCN1CCOCC1)c(C)n2C(=O)c1cccc(Cl)c1Cl	C23H24Cl2N2O3	cannabinoid
+COc1ccc(C(=O)c2c(C)n(CCN3CCOCC3)c3cc(Br)ccc23)cc1	C23H25BrN2O3	cannabinoid
+O=C(c1cccc2ccccc12)c1cn(Cc2ccc(F)cc2)c2ccccc12	C26H18FNO	cannabinoid
+CC(C)[C@H](NC(=O)c1cc(-c2ccc(F)cc2)nn1CC1CCCCC1)C(N)=O	C22H29FN4O2	cannabinoid
+CC(C)(C)c1cc(/C=N/NC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)cc(C(C)(C)C)c1O	C23H27N3O6	cannabinoid
+Cc1c(C(=O)NN2CCS(=O)(=O)CC2)nn(-c2ccc(Cl)cc2Cl)c1-c1ccc(C#CCCC#N)cc1	C26H23Cl2N5O3S	cannabinoid
+CCOc1ccc(C[C@@H](c2cccc(C#N)c2)[C@H](C)NC(=O)C(C)(C)Oc2ccc(C)cn2)cc1	C29H33N3O3	cannabinoid
+O=C(NN1CCCCC1)c1nn(-c2ccc(Cl)cc2Cl)c2c1CCCc1cc(Cl)ccc1-2	C24H23Cl3N4O	cannabinoid
+CC(F)(F)CN1CCOc2c(nn(-c3ccccc3Cl)c2-c2ccc(Cl)cc2)C1=O	C21H17Cl2F2N3O2	cannabinoid
+O=C(NCc1ccc(F)cc1)c1ccc(S(=O)(=O)n2cc(N3CCCCC3)c3ccccc32)cc1	C27H26FN3O3S	cannabinoid
+O=C(NN1CCCCC1)C1=NN(c2ccc(Cl)cc2Cl)C(c2ccc(Cl)cc2)C1	C21H21Cl3N4O	cannabinoid
+CCc1c(C(=O)NN2CCCCC2)nn(-c2ccc(Cl)cc2Cl)c1-c1ccc(Br)cc1	C23H23BrCl2N4O	cannabinoid
+Cc1c(/C=C/C2CCCCC2)nn(-c2ccc(Cl)cc2Cl)c1-c1ccc(Cl)cc1	C24H23Cl3N2	cannabinoid
+CC(NC(C)(C)CO)C(=O)c1cccc(Cl)c1	C13H18ClNO2	beta-ketone
+CCNC(C)C(=O)c1ccccc1C	C12H17NO	beta-ketone
+CCc1ccccc1C(=O)C(C)NC	C12H17NO	beta-ketone
+CCNC(C)C(=O)c1ccccc1CC	C13H19NO	beta-ketone
+CCc1cccc(C(=O)C(C)NC)c1	C12H17NO	beta-ketone
+CCNC(C)C(=O)c1cccc(CC)c1	C13H19NO	beta-ketone
+COc1ccccc1CNC(C)C(=O)c1ccc(C)cc1	C18H21NO2	beta-ketone
+CCCNC(C)C(=O)c1ccc(C)cc1	C13H19NO	beta-ketone
+CCCCNC(C)C(=O)c1ccc(C)cc1	C14H21NO	beta-ketone
+Cc1ccc(C(=O)C(C)N(C)C)cc1	C12H17NO	beta-ketone
+CCN(C)C(C)C(=O)c1ccc(C)cc1	C13H19NO	beta-ketone
+CCN(CC)C(C)C(=O)c1ccc(C)cc1	C14H21NO	beta-ketone
+CCNC(C)C(=O)c1ccc(C)cc1C	C13H19NO	beta-ketone
+CNC(C)C(=O)c1cc(C)c(C)cc1C	C13H19NO	beta-ketone
+CNC(C)C(=O)c1cc(C)c(C)c(C)c1	C13H19NO	beta-ketone
+CNC(C)C(=O)c1cc(OC)c(OC)cc1OC	C13H19NO4	beta-ketone
+CNC(C)C(=O)c1cc(OC)c(OC)c(OC)c1	C13H19NO4	beta-ketone
+COc1ccc(C(=O)C(C)N(C)C)cc1	C12H17NO2	beta-ketone
+CCNC(C)C(=O)c1ccc(OC)cc1	C12H17NO2	beta-ketone
+CNC(C)C(=O)c1ccc(OC)cc1OC	C12H17NO3	beta-ketone
+CNC(C)C(=O)c1ccc(OC)c(OC)c1	C12H17NO3	beta-ketone
+CCCOc1ccc(C(=O)C(C)NC)cc1OC	C14H21NO3	beta-ketone
+CNC(C)C(=O)c1ccc(C)c(OC)c1	C12H17NO2	beta-ketone
+CC(N)C(=O)c1ccccc1F	C9H10FNO	beta-ketone
+CC(C(=O)c1ccccc1F)N1CCCC1	C13H16FNO	beta-ketone
+CC(N)C(=O)c1cccc(F)c1	C9H10FNO	beta-ketone
+CC(C(=O)c1cccc(F)c1)N1CCCC1	C13H16FNO	beta-ketone
+CCC(C(=O)c1cccc(F)c1)N1CCCC1	C14H18FNO	beta-ketone
+CCC(NC)C(=O)c1cccc(F)c1	C11H14FNO	beta-ketone
+CNC(C)C(=O)c1ccc(C)c(F)c1	C11H14FNO	beta-ketone
+CNC(C)C(=O)c1ccccc1Cl	C10H12ClNO	beta-ketone
+CCNC(C)C(=O)c1ccccc1Cl	C11H14ClNO	beta-ketone
+CNC(C)C(=O)c1ccccc1Br	C10H12BrNO	beta-ketone
+CNC(C)C(=O)c1ccccc1I	C10H12INO	beta-ketone
+CNC(C)C(=O)c1ccc(Cl)c(Cl)c1	C10H11Cl2NO	beta-ketone
+CNC(C)C(=O)c1cccc(I)c1	C10H12INO	beta-ketone
+CCC(NC)C(=O)c1ccc(Br)cc1	C11H14BrNO	beta-ketone
+CCCC(C(=O)c1ccc(Cl)cc1)N1CCCC1	C15H20ClNO	beta-ketone
+CCNC(C)C(=O)c1ccc(Cl)cc1	C11H14ClNO	beta-ketone
+CCCNC(C)C(=O)c1ccc(Cl)cc1	C12H16ClNO	beta-ketone
+CCOC(=O)[C@@H](NC(=O)c1nn(CCCCCF)c2ccccc12)C(C)(C)C	C21H30FN3O3	cannabinoid
+CCc1c2c(c(CCN)c3c1OCC3)OCC2	C14H19NO2	unknown
+CCCSc1c2c(c(CCN)c3c1OCC3)OCC2	C15H21NO2S	unknown
+CCOc1ccc(Cl)cc1CNCCc1cc(OC)c(Br)cc1OC	C19H23BrClNO3	unknown
+CC(C)NC(C)C(=O)c1ccc(Cl)cc1	C12H16ClNO	beta-ketone
+CCCCNC(C)C(=O)c1ccc(Cl)cc1	C13H18ClNO	beta-ketone
+CC(C(=O)c1ccc(Cl)cc1)N(C)C	C11H14ClNO	beta-ketone
+CNC(C)C(=O)c1ccc(CCF)cc1	C12H16FNO	beta-ketone
+CNC(C)C(=O)c1ccc(SC)cc1	C11H15NOS	beta-ketone
+CNC(C)C(=O)c1ccc(S(C)(=O)=O)cc1	C11H15NO3S	beta-ketone
+CNC(C)C(=O)c1ccc(-c2ccccc2)cc1	C16H17NO	beta-ketone
+CNC(C)C(=O)c1ccc(C(C)C)cc1	C13H19NO	beta-ketone
+COc1cc(C(=O)CN)c(OC)cc1Cl	C10H12ClNO3	beta-ketone
+COc1cc(C(=O)CN)c(OC)cc1C	C11H15NO3	beta-ketone
+CCc1cc(OC)c(C(=O)CN)cc1OC	C12H17NO3	beta-ketone
+CCCc1cc(OC)c(C(=O)CN)cc1OC	C13H19NO3	beta-ketone
+COc1cc(C(C)C)c(OC)cc1C(=O)CN	C13H19NO3	beta-ketone
+COc1cc(C(=O)C(C)N)c(OC)cc1Cl	C11H14ClNO3	beta-ketone
+COc1cc(C(=O)C(C)N)c(OC)cc1C	C12H17NO3	beta-ketone
+CNC(C)C(=O)c1cc(OC)c(C)cc1OC	C13H19NO3	beta-ketone
+CC(=O)NC(C)C(=O)c1ccc2c(c1)OCO2	C12H13NO4	beta-ketone
+CC(=O)N(C)C(C)C(=O)c1ccc2c(c1)OCO2	C13H15NO4	beta-ketone
+CC(C(=O)c1ccc2c(c1)OCO2)N(C)O	C11H13NO4	beta-ketone
+CNC(C)C(=O)c1cccc2c1OCO2	C11H13NO3	beta-ketone
+CCN(C(C)=O)C(C)C(=O)c1ccc2c(c1)OCO2	C14H17NO4	beta-ketone
+CCN(C)C(C)C(=O)c1ccc2c(c1)OCO2	C13H17NO3	beta-ketone
+CC(NCc1ccccc1)C(=O)c1ccc2c(c1)OCO2	C17H17NO3	beta-ketone
+CNC(C)C(=O)c1ccc2c(c1)OCCO2	C12H15NO3	beta-ketone
+CNC(C)C(=O)c1ccc2c(c1)CCC2	C13H17NO	beta-ketone
+COc1cc(C(=O)CNCc2ccccc2OC)c(OC)cc1Br	C18H20BrNO4	beta-ketone
+CCC(C(=O)c1ccc(C)cc1)N(C)C	C13H19NO	beta-ketone
+CCC(NCc1ccccc1)C(=O)c1ccc2c(c1)OCO2	C18H19NO3	beta-ketone
+CCC(NCc1ccccc1)C(=O)c1ccc(C)cc1	C18H21NO	beta-ketone
+CCNC(CC)C(=O)c1ccc(F)cc1	C12H16FNO	beta-ketone
+CCNC(CC)C(=O)c1ccc(OC)cc1	C13H19NO2	beta-ketone
+COc1cc(C(=O)C(C)N)c(OC)c2c1OCO2	C12H15NO5	beta-ketone
+CNC(C)C(=O)c1cc(C)c2c(c1)OCO2	C12H15NO3	beta-ketone
+CCCC(NCC)C(=O)c1ccc(C)cc1	C14H21NO	beta-ketone
+CCCC(NC)C(=O)c1ccc(F)cc1	C12H16FNO	beta-ketone
+CCCC(NCC)C(=O)c1ccc(OC)c(OC)c1	C15H23NO3	beta-ketone
+CCCC(NC(C)C)C(=O)c1ccc(F)cc1	C14H20FNO	beta-ketone
+CCCCC(NC)C(=O)c1ccc(F)cc1	C13H18FNO	beta-ketone
+CCCCC(NC)C(=O)c1ccc(C)cc1	C14H21NO	beta-ketone
+CCCCCCC(NC)C(=O)c1ccc(F)cc1	C15H22FNO	beta-ketone
+CNC(C(=O)c1ccc(C)cc1)c1ccccc1	C16H17NO	beta-ketone
+CNC(C(=O)c1ccc2c(c1)OCO2)c1ccccc1	C16H15NO3	beta-ketone
+CNC(C(=O)c1ccc2c(c1)OCO2)C1CC1	C13H15NO3	beta-ketone
+CNC(C)C(=O)c1ccc2ccccc2c1	C14H15NO	beta-ketone
+CCNC(C(=O)c1ccccc1)C1CCCO1	C14H19NO2	beta-ketone
+CCC(NC)C(=O)c1cccs1	C9H13NOS	unknown
+CCNC(C)C(=O)c1cccs1	C9H13NOS	unknown
+CC(C(=O)c1cccs1)N1CCCC1	C11H15NOS	unknown
+CNC(C)C(=O)c1cc2ccccc2o1	C12H13NO2	unknown
+CNC(C)C(=O)c1cccc2occc12	C12H13NO2	beta-ketone
+CNC(C)C(=O)c1ccc2occc2c1	C12H13NO2	beta-ketone
+CNC(C)C(=O)c1ccc2ccoc2c1	C12H13NO2	beta-ketone
+CC(N)C(=O)c1ccc2[nH]ccc2c1	C11H12N2O	beta-ketone
+CCC(C(=O)c1ccccc1)N1CCCCC1	C15H21NO	beta-ketone
+CCCC(C(=O)c1ccc(F)cc1)N1CCCCC1	C16H22FNO	beta-ketone
+CSc1ccc(C(=O)C(C)(C)N2CCOCC2)cc1	C15H21NO2S	beta-ketone
+CCCCCCC(C(=O)c1ccccc1)N1CCCC1	C18H27NO	beta-ketone
+CCCCCCCC(C(=O)c1ccccc1)N1CCCC1	C19H29NO	beta-ketone
+Cc1ccccc1C(=O)C(C)N1CCCC1	C14H19NO	beta-ketone
+Cc1cccc(C(=O)C(C)N2CCCC2)c1	C14H19NO	beta-ketone
+CC(C(=O)c1ccc(F)cc1)N1CCCC1	C13H16FNO	beta-ketone
+CC(C(=O)c1ccc(Cl)cc1)N1CCCC1	C13H16ClNO	beta-ketone
+Cc1ccc(C(=O)C(C)N2CCCC2)c(C)c1	C15H21NO	beta-ketone
+CCC(C(=O)c1ccc(F)cc1)N1CCCC1	C14H18FNO	beta-ketone
+CCC(C(=O)c1cccc(C)c1)N1CCCC1	C15H21NO	beta-ketone
+CCCCC(C(=O)c1ccc(F)cc1)N1CCCC1	C16H22FNO	beta-ketone
+CCCCC(C(=O)c1ccc(Cl)cc1)N1CCCC1	C16H22ClNO	beta-ketone
+Cc1ccc(C(=O)C(c2ccccc2)N2CCCC2)cc1	C19H21NO	beta-ketone
+CCCC(C(=O)c1cccc2c1OCO2)N1CCCC1	C16H21NO3	beta-ketone
+CCCCCC(C(=O)c1ccc(OC)cc1)N1CCCC1	C18H27NO2	beta-ketone
+CC(C)(C(=O)c1ccc2c(c1)OCO2)N1CCCC1	C15H19NO3	beta-ketone
+CCCC(C(=O)c1cc(C)c2c(c1)OCO2)N1CCCC1	C17H23NO3	beta-ketone
+CCCC(C(=O)c1cc2c(cc1C)OCO2)N1CCCC1	C17H23NO3	beta-ketone
+CCCC(C(=O)c1cc2c(cc1OC)OCO2)N1CCCC1	C17H23NO4	beta-ketone
+CCCC(C(=O)c1cc(Br)c(OC)c2c1OCO2)N1CCCC1	C17H22BrNO4	beta-ketone
+CCCC(C(=O)c1ccc2c(c1)OCCO2)N1CCCC1	C17H23NO3	beta-ketone
+CCC(C(=O)c1ccc2c(c1)CCC2)N1CCCC1	C17H23NO	beta-ketone
+CC(N)CC1CC=CCC1	C9H17N	unknown
+CCCC(C(=O)c1ccc2c(c1)CCCC2)N1CCCC1	C19H27NO	beta-ketone
+CCCCC(C(=O)c1ccc2c(c1)CCCC2)N1CCCC1	C20H29NO	beta-ketone
+CCCC(C(=O)c1coc2ccccc12)N1CCCC1	C17H21NO2	unknown
+CNC(CC(C)C)C1(c2ccc(Cl)cc2)CCC1	C16H24ClN	unknown
+CNC(CC(C)C)C1(c2ccc3c(c2)OCO3)CCC1	C17H25NO2	unknown
+CNC(C)C1(c2ccc3c(c2)OCO3)CCC1	C14H19NO2	unknown
+CNC(C)C1(c2ccc3c(c2)OCO3)COC1	C13H17NO3	unknown
+CCCC(N1CCCC1)C1(c2ccc3c(c2)OCO3)CCC1	C19H27NO2	unknown
+CCCC(N1CCCC1)C1(c2ccc3c(c2)OCO3)COC1	C18H25NO3	unknown
+CCC1NCCOC1c1cccc(F)c1	C12H16FNO	unknown
+Cc1cccc(C2OCCNC2C)c1	C12H17NO	unknown
+CC1NCCOC1c1cccc(Cl)c1	C11H14ClNO	unknown
+CC(C)CC(C(=O)c1ccccc1)N1CCCC1	C16H23NO	beta-ketone
+CCCC(NCC)C(=O)c1ccc(Cl)cc1	C13H18ClNO	beta-ketone
+CCNC(C)Cc1cc2ccccc2o1	C13H17NO	unknown
+CCN(CC)CC(C)(C)COC(=O)c1ccc([N+](=O)[O-])cc1	C16H24N2O4	unknown
+CCNCCc1coc2ccc(OC)cc12	C13H17NO2	unknown
+CC(C)C(=O)N(c1ccccc1)C1CCN(CCc2ccccc2)CC1	C23H30N2O	fentanyl
+CCCC(=O)N(c1ccc(O)cc1)C1CCN(CCc2ccccc2)CC1	C23H30N2O2	fentanyl
+CN(C(=O)Cc1ccc(Cl)c(Cl)c1)[C@@H]1CCCC[C@H]1N1CCCC1	C19H26Cl2N2O	unknown
+C=CCN(C)CCc1c[nH]c2cccc(OC(C)=O)c12	C16H20N2O2	tryptamine
+CCOc1ccccc1OCC1CNCCO1	C13H19NO3	unknown
+O=C(OCCN1CCOCC1)C1(c2ccccc2)CCCCC1	C19H27NO3	arylcycloalkylamine
+Cc1ccc(C(=O)C(C)N(C)Cc2ccccc2)cc1	C18H21NO	beta-ketone
+COCC(C(=O)c1ccccc1)N1CCCC1	C14H19NO2	beta-ketone
+Cn1c2ccccc2c2ccncc21	C12H10N2	unknown
+CN(CCc1c[nH]c2ccccc12)C1CC1	C14H18N2	tryptamine
+COC(=O)[C@@H]1C2CCC(C[C@@H]1OC(=O)c1ccccc1)N2C	C17H21NO4	unknown
+COC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc(Cl)c(Cl)c1)N2C	C16H19Cl2NO2	unknown
+Clc1cccc(N2CCNCC2)c1Cl	C10H12Cl2N2	unknown
+Cc1ccc(C2CN=C(N)O2)cc1C	C11H14N2O	unknown
+CCCNC(C)(C)COC(=O)c1ccccc1	C14H21NO2	unknown
+CC1COC(c2ccccc2)CN1	C11H15NO	unknown
+CCN1CCOC(c2ccccc2)C1C	C13H19NO	unknown
+CCC1C(c2ccccc2)OCCN1C	C13H19NO	unknown
+COC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccccc1)N2C	C16H21NO2	unknown
+NC(=O)CS(=O)C(c1ccccc1)c1ccccc1	C15H15NO2S	unknown
+O=C(CS(=O)C(c1ccc(F)cc1)c1ccc(F)cc1)NO	C15H13F2NO3S	unknown
+CC(C(=O)c1ccc(Br)cc1)N1CCCC1	C13H16BrNO	beta-ketone
+CCC(Cc1cc2ccccc2o1)NC	C13H17NO	unknown
+CC(C)CCNc1ncccc1C(=O)N1CCN(Cc2ccccc2)CC1	C22H30N4O	unknown
+CCC(=O)N(c1ccccc1F)C1CCN(CCc2ccccc2F)CC1	C22H26F2N2O	fentanyl
+COc1cc2c(cc1Br)OCCCC2CN	C12H16BrNO2	unknown
+COc1cc2c(cc1Br)OCCC2CN	C11H14BrNO2	unknown
+COc1cc2c(cc1Br)OCC2CN	C10H12BrNO2	unknown
+CN1CC(c2ccccc2)OC1=N	C10H12N2O	unknown
+COC(=O)C(c1cccs1)C1CCCCN1	C12H17NO2S	unknown
+NCCC1=CCC=CC1	C8H13N	unknown
+CCCCOC(=O)C(c1ccccc1)C1CCCCN1	C17H25NO2	unknown
+COC(=O)C(c1ccc(Cl)cc1)C1CCCCN1	C14H18ClNO2	unknown
+COC(=O)C(c1ccc(Br)cc1)C1CCCCN1	C14H18BrNO2	unknown
+COC(=O)C(c1ccc(OC)cc1)C1CCCCN1	C15H21NO3	unknown
+COC(=O)C(c1ccc2c(c1)OCO2)C1CCCCN1	C15H19NO4	unknown
+COC(=O)C(c1ccc([N+](=O)[O-])cc1)C1CCCCN1	C14H18N2O4	unknown
+COC(=O)C(c1cccc(C)c1)C1CCCCN1	C15H21NO2	unknown
+COC(=O)C(c1cccc(Cl)c1)C1CCCCN1	C14H18ClNO2	unknown
+COC(=O)C(c1cccc(Br)c1)C1CCCCN1	C14H18BrNO2	unknown
+CCOC(=O)C(c1ccc(Br)cc1)C1CCCCN1	C15H20BrNO2	unknown
+CC(C)OC(=O)C(c1ccc(F)cc1)C1CCCCN1	C16H22FNO2	unknown
+CCCC(c1ccc(Cl)c(Cl)c1)C1CCCCN1	C15H21Cl2N	unknown
+CC1N=C(N)OC1c1ccc(F)cc1	C10H11FN2O	unknown
+CC1N=C(N)OC1c1cccc(F)c1	C10H11FN2O	unknown
+COc1ccc(C2OC(N)=NC2C)cc1	C11H14N2O2	unknown
+COc1cc(C2OC(N)=NC2C)cc(OC)c1OC	C13H18N2O4	unknown
+COc1cc(C2CN=C(N)O2)c(OC)cc1Br	C11H13BrN2O3	unknown
+NC1=NCC(c2ccc(F)cc2)O1	C9H9FN2O	unknown
+CN(C)C1=NCC(c2ccccc2)O1	C11H14N2O	unknown
+CC1(C)N=C(N)OC1c1ccccc1	C11H14N2O	unknown
+Cc1ccc(C(C)C(C)N)cc1	C11H17N	unknown
+CNC(C)C(C)c1ccc(C)cc1	C12H19N	unknown
+CC(N)C(C)c1ccc(F)cc1	C10H14FN	unknown
+CCCC(C(C)c1ccc2c(c1)OCO2)N1CCCC1	C17H25NO2	unknown
+CNC1CCCCC1c1ccccc1	C13H19N	unknown
+Cc1ccc(C(=O)C2CCCCN2)cc1	C13H17NO	unknown
+Cc1ccc(C2(C(C)N)CCC2)cc1	C13H19N	unknown
+CC(C(O)c1ccccc1)N1CCCC1	C13H19NO	unknown
+OC(c1ccccc1)(c1cccs1)C1CCCCN1	C16H19NOS	unknown
+CCC(=O)C(Cc1ccccc1)N1CCCCC1	C16H23NO	unknown
+CCC[C@@H]1CN(C)CC[C@@H]1c1ccc(Cl)cc1	C15H22ClN	unknown
+Cc1cc([C@@H]2C3CCC(C[C@@H]2c2ccc(F)cc2)S3)on1	C17H18FNOS	unknown
+CCN(CC)C(C)CC(=O)N(C)c1ccccc1	C15H24N2O	unknown
+CC(N)CC1=CCC=CC1	C9H15N	unknown
+CC(N)CC1CCCCCC1	C10H21N	unknown
+CC(N)CC1CCCCCCC1	C11H23N	unknown
+NCCC1C=CC=CC=C1	C9H13N	unknown
+CC(N)CC1C=CC=CC=C1	C10H15N	unknown
+CNC(C)CC1C=CC=CC=C1	C11H17N	unknown
+CC12CC3CC(C1)CC(N)(C3)C2	C11H19N	unknown
+CC12CC3CC(C)(C1)CC(N)(C3)C2	C12H21N	unknown
+CC(N)CC1CC2CC1C1CCCC21	C13H23N	unknown
+Cc1nc2ccccc2c(=O)n1-c1ccccc1Br	C15H11BrN2O	unknown
+CCc1ccccc1-n1c(C)nc2ccccc2c1=O	C17H16N2O	unknown
+Cc1nc2ccccc2c(=O)n1-c1ccccc1Cl	C15H11ClN2O	unknown
+CCc1nc2ccccc2c(=O)n1-c1c(Cl)cccc1Cl	C16H12Cl2N2O	unknown
+Cc1ccc(-n2c(C)nc3ccccc3c2=O)c(C)c1	C17H16N2O	unknown
+Cc1nc2ccccc2c(=O)n1CC(O)CO	C12H14N2O3	unknown
+COC(=O)[C@@H]1C2CCC(C[C@@H]1OC(=O)c1ccc(F)cc1)N2C	C17H20FNO4	unknown
+CNC(C)Cc1cccc(Cl)c1	C10H14ClN	unknown
+CNC(C)Cc1cccc(Br)c1	C10H14BrN	unknown
+CNC(C)Cc1cccc(C)c1	C11H17N	unknown
+c1ccc(CN2CCN(Cc3ccccc3)CC2)cc1	C18H22N2	unknown
+CCC(=O)N1CCN(C(=O)c2ccccc2)CC1	C14H18N2O2	unknown
+Cc1cccc(C)c1NC(=O)CN1CCCCC1	C15H22N2O	unknown
+Fc1ccccc1C(Cc1ccccc1)N1CCCC1	C18H20FN	unknown
+COc1ccc(/C=C2\CCCN=C2c2cccnc2)c(OC)c1	C19H20N2O2	unknown
+CC(C)N1CCOC(c2cccc(C(F)(F)F)c2)C1	C14H18F3NO	unknown
+CCCC(NC)C(=O)c1ccc2c(c1)CCC2	C15H21NO	beta-ketone
+CCCC(C(=O)c1ccc2c(c1)CCC2)N1CCCC1	C18H25NO	beta-ketone
+CC(C)C(NC(=O)Cc1ccc(Cl)cc1)C(N)=O	C13H17ClN2O2	unknown
+Fc1ccccc1NC1CCN(CCc2ccccc2)CC1	C19H23FN2	fentanyl
+CCN1CCOC(O)(c2ccccc2)C1C	C13H19NO2	unknown
+c1ccc(C(c2ccccc2)C2COCCN2)cc1	C17H19NO	unknown
+CCN(CCO)C(C)C(O)c1ccccc1	C13H21NO2	unknown
+CCc1ccc(C(O)C(C)NC)cc1	C12H19NO	unknown
+CCNC(C)C(O)c1ccc(C)cc1	C12H19NO	unknown
+CC(/C=N/O)Cc1ccc2c(c1)OCO2	C11H13NO3	unknown
+COc1cc(CN2CCNCC2)cc(OC)c1OC	C14H22N2O3	unknown
+Cc1ccccc1-n1c(C)nc2ccccc2c1=O	C16H14N2O	unknown
+CC(C)(C)[C@H](NC(=O)c1cn(Cc2ccccc2)c2ccccc12)C(N)=O	C22H25N3O2	cannabinoid
+CCCn1cc(C(=O)c2cccc3ccccc23)c2ccccc21	C22H19NO	cannabinoid
+O=C(O)CCn1cc(C(=O)c2cccc3ccccc23)c2ccccc21	C22H17NO3	cannabinoid
+CCCCCCc1nc(-c2ccc(Cl)cc2)n(-c2ccc(Cl)cc2Cl)n1	C20H20Cl3N3	cannabinoid
+CCCCCn1cc(C(=O)c2cccc3cc(OC)ccc23)c2ccccc21	C25H25NO2	cannabinoid
+CCCCCn1cc(C(=O)c2cccc3ccccc23)cc1-c1cccc(F)c1	C26H24FNO	cannabinoid
+CCCCCn1cc(C(=O)c2cccc3ccccc23)cc1-c1ccccc1Cl	C26H24ClNO	cannabinoid
+CCC(F)CCn1nc(C(=O)N[C@H](C(=O)OC)C(C)C)c2ccccc21	C19H26FN3O3	cannabinoid
+O=C(c1cccc2ccccc12)c1nn(CCCCCBr)c2ccccc12	C23H21BrN2O	cannabinoid
+CCCCCn1nc(C(=O)N[C@@H](CCCC)C(N)=O)c2ccccc21	C19H28N4O2	cannabinoid
+CCCCCn1nc(C(=O)N[C@](C)(C(N)=O)C(C)C)c2ccccc21	C19H28N4O2	cannabinoid
+CCCCCn1nc(C(=O)N[C@H](C(N)=O)[C@@H](C)CC)c2ccccc21	C19H28N4O2	cannabinoid
+CCC(C(=O)c1ccc2c(c1)CCCC2)N1CCCC1	C18H25NO	beta-ketone
+COc1ccc(CN2CCNCC2)c(OC)c1OC	C14H22N2O3	unknown
+COc1cc(Br)c(O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2O)cc1CCNCc1ccccc1OC	C23H28BrNO9	unknown
+COc1cc(CCNCc2ccccc2OC)c(O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2O)cc1Br	C23H28BrNO9	unknown
+COc1cc(CCNCc2ccccc2O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2O)c(OC)cc1Br	C23H28BrNO9	unknown
+COc1cc(Br)c(OCC[18F])cc1CCNCc1ccccc1OC	C19H23BrFNO3	unknown
+COc1cc(CCNCc2ccccc2OC)c(OCC[18F])cc1Br	C19H23BrFNO3	unknown
+COc1cc(CCNCc2ccccc2OCC[18F])c(OC)cc1Br	C19H23BrFNO3	unknown
+COc1ccccc1CNCCc1cc(O)c(Br)cc1O	C16H18BrNO3	unknown
+COc1cc(CCNCc2ccccc2O)c(O)cc1Br	C16H18BrNO3	unknown
+COc1cc(Br)c(O)cc1CCNCc1ccccc1O	C16H18BrNO3	unknown
+COc1cc(CCNCc2cc(O)ccc2OC)c(O)cc1Br	C17H20BrNO4	unknown
+COc1cc(CCNCc2cc(O)ccc2O)c(OC)cc1Br	C17H20BrNO4	unknown
+COc1cc(C(O)CNCc2ccccc2OC)c(O)cc1Br	C17H20BrNO4	unknown
+COc1cc(/C=C/NCc2ccccc2OC)c(OC)cc1Br	C18H20BrNO3	unknown
+COc1cc(/C=C/N)c(OC)cc1Br	C10H12BrNO2	unknown
+COc1cc(Sc2ccccc2)c(OC)cc1/C=C(\C)[N+](=O)[O-]	C17H17NO4S	unknown
+COc1cc(SC2CCCCC2)c(OC)cc1/C=C(\C)[N+](=O)[O-]	C17H23NO4S	unknown
+COc1cc(SC2CCCCC2)c(OC)cc1C=O	C15H20O3S	unknown
+CC/C(=C\c1cc(OC)c(OC)c(OC)c1)[N+](=O)[O-]	C13H17NO5	unknown
+COc1cc(CCNCc2cc(O)ccc2OC)c(OC)cc1Br	C18H22BrNO4	unknown
+COc1cc(CCNCc2ccc(O)cc2OC)c(OC)cc1Br	C18H22BrNO4	unknown
+COc1cc(C(O)CNCc2ccccc2OC)c(OC)cc1Br	C18H22BrNO4	unknown
+COc1cc(Br)c2[nH]cc(CCN)c2c1	C11H13BrN2O	tryptamine
+COc1cc(Br)c2c(c1)c(CCN)cn2C	C12H15BrN2O	tryptamine
+COc1cc(I)c2[nH]cc(CCN)c2c1	C11H13IN2O	tryptamine
+COc1cc(I)c2[nH]cc(CC(C)N)c2c1	C12H15IN2O	tryptamine
+COc1ccc2c(c1)c(CCN)cn2C	C12H16N2O	tryptamine
+COc1cc(C)c2[nH]cc(CCN)c2c1	C12H16N2O	tryptamine
+COc1cc(Br)c2[nH]cc(CCNCc3ccccc3OC)c2c1	C19H21BrN2O2	tryptamine
+COc1cccc(CNCCc2c[nH]c3c(Br)cc(OC)cc23)c1	C19H21BrN2O2	tryptamine
+COc1ccc(OC)c2c(CCN)c[nH]c12	C12H16N2O2	tryptamine
+COc1ccc(OC)c2c(CC(C)N)c[nH]c12	C13H18N2O2	tryptamine
+COc1ccccc1CNCCc1c[nH]c2c(OC)ccc(OC)c12	C20H24N2O3	tryptamine
+COc1ccc(OC)c2c(CCNCc3ccccc3)c[nH]c12	C19H22N2O2	tryptamine
+COc1ccc(OC)c2c(CCNCc3ccccc3Cl)c[nH]c12	C19H21ClN2O2	tryptamine
+CCN(CC)CCc1c[nH]c2c(OC)ccc(OC)c12	C16H24N2O2	tryptamine
+COc1cc2[nH]cc(CCN)c2cc1OC	C12H16N2O2	tryptamine
+COc1ccccc1CNCCc1c[nH]c2cc(OC)c(OC)cc12	C20H24N2O3	tryptamine
+COc1cc(OC)c2[nH]cc(CCN)c2c1	C12H16N2O2	tryptamine
+COc1cc(OC)c2[nH]cc(CCNCc3ccccc3OC)c2c1	C20H24N2O3	tryptamine
+COc1cc2c3c(c1)c(CCN)cn3CCC2	C14H18N2O	unknown
+COc1cc2c3c(c1)C(CCN)CN3CCC2	C14H20N2O	unknown
+COc1cc(Br)c2[nH]cc(CC(C)NCc3ccccc3OC)c2c1	C20H23BrN2O2	tryptamine
+COc1cc(I)c2[nH]cc(CCNCc3ccccc3OC)c2c1	C19H21IN2O2	tryptamine
+COc1cc(Br)c2[nH]cc(CCN(C)Cc3ccccc3OC)c2c1	C20H23BrN2O2	tryptamine
+COc1cc(Br)c2c(c1)CC(c1c[nH]c3c(Br)cc(OC)cc13)N2	C18H16Br2N2O2	unknown
+C=CCN(C)CCc1c[nH]c2cccc(O)c12	C14H18N2O	tryptamine
+COC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc(F)cc1)N2C	C16H20FNO2	unknown
+COC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc(F)cc1)N2	C15H18FNO2	unknown
+COC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc(Cl)cc1)N2C	C16H20ClNO2	unknown
+COC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc(Cl)c(C)c1)N2C	C17H22ClNO2	unknown
+COC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc(C)cc1)N2C	C17H23NO2	unknown
+CCc1ccc([C@H]2CC3CCC([C@H]2C(=O)OC)N3C)cc1	C18H25NO2	unknown
+COC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc(I)cc1)N2C	C16H20INO2	unknown
+CC(C)OC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc(I)cc1)N2C	C18H24INO2	unknown
+C=CCN1C2CCC1[C@@H](C(=O)OC)[C@@H](c1ccc(I)cc1)C2	C18H22INO2	unknown
+NC(=O)CS(=O)C(c1ccc(Cl)cc1)c1ccc(Cl)cc1	C15H13Cl2NO2S	unknown
+Cc1nnc2n1-c1sc(Cl)cc1C(c1ccccc1F)=NC2	C15H10ClFN4S	aryldiazepine
+CCc1cccc(N(C)/C(N)=N/c2cccc3ccccc23)c1	C20H21N3	unknown
+c1ccc(CC2CCNCC2)cc1	C12H17N	unknown
+CCN(CC)C(C)(C)COC(=O)c1ccc(C)cc1	C16H25NO2	unknown
+c1ccc2c(c1)CC(N1CCCC1)C2	C13H17N	unknown
+Cc1nnc2ccc(-c3cccc(C(F)(F)F)c3)nn12	C13H9F3N4	unknown
+CCN(CC)CC(C)(C)COC(=O)c1ccc(N)cc1	C16H26N2O2	unknown
+C(=C/c1ccccc1)\CN1CCN(CCOC(c2ccccc2)c2ccccc2)CC1	C28H32N2O	unknown
+CCNC1CCCC1c1ccccc1	C13H19N	unknown
+CC(C)CCC(=O)CC1c2ccccc2C(=O)N1c1ccc2ccc(Cl)nc2n1	C23H22ClN3O2	unknown
+CN1CCC(c2c[nH]c3ccccc23)CC1	C14H18N2	unknown
+O=C(N[C@H]1c2ccccc2C[C@H]1O)c1cn(CC2CCCCC2)c2ccccc12	C25H28N2O2	cannabinoid
+CCC(=O)N(c1ccccc1)C1CCN(C2CC2c2ccccc2)CC1	C23H28N2O	fentanyl
+CCCCCn1cc(C(=O)NCc2ccc(F)cc2)c2ccccc21	C21H23FN2O	cannabinoid
+CN1[C@@H]2CCC[C@H]1C[C@@H](NC(=O)c1nn(CCCCCF)c3ccccc13)C2	C22H31FN4O	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1cn(CCCC(F)(F)F)c2ccccc12)C(N)=O	C19H24F3N3O2	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1cn(CC2CCOCC2)c2ccccc12)C(N)=O	C21H29N3O3	cannabinoid
+O=C(NC1CCCCCC1)c1nn(CCCCCF)c2ccccc12	C20H28FN3O	cannabinoid
+O=C(N[C@H]1CCCc2ccccc21)c1cn(CC2CCCCC2)c2ccccc12	C26H30N2O	cannabinoid
+CCC(=O)N(c1ccccc1)C1(C(=O)OC)CCN(C)CC1	C17H24N2O3	fentanyl
+CN(C#N)CCc1c[nH]c2ccccc12	C12H13N3	tryptamine
+COc1ccc2[nH]cc(C(=O)CN(C(C)C)C(C)C)c2c1	C17H24N2O2	tryptamine
+COc1ccc2[nH]cc(C(O)CN(C(C)C)C(C)C)c2c1	C17H26N2O2	tryptamine
+O=C1CN=C(c2ccccc2F)c2cc(Cl)ccc2N1	C15H10ClFN2O	aryldiazepine
+CCCCCn1nc2ccccc2c1C(=O)NC12CC3CC(CC(C3)C1)C2	C23H31N3O	cannabinoid
+COc1cc(C(C)(C)C)c(OC)cc1C=O	C13H18O3	unknown
+COc1cc(C(C)(C)C)c(OC)cc1/C=C/[N+](=O)[O-]	C14H19NO4	unknown
+COc1cc(CCNC(=O)C(F)(F)F)c(OC)cc1I	C12H13F3INO3	unknown
+C=Cc1cc(OC)c(CCNC(=O)C(F)(F)F)cc1OC	C14H16F3NO3	unknown
+CC#Cc1cc(OC)c(CCNC(=O)C(F)(F)F)cc1OC	C15H16F3NO3	unknown
+COc1cc(CC(F)(F)F)c(OC)cc1C=O	C11H11F3O3	unknown
+COc1cc(CC(F)(F)F)c(OC)cc1/C=C/[N+](=O)[O-]	C12H12F3NO4	unknown
+COc1cc(CC(F)(F)F)c(OC)cc1/C=C(\C)[N+](=O)[O-]	C13H14F3NO4	unknown
+COc1cc(CC(C)=O)c(OC)cc1CO	C12H16O4	unknown
+COc1ccc(O)c(C=O)c1	C8H8O3	unknown
+COc1ccc(OC(F)F)c(C=O)c1	C9H8F2O3	unknown
+COc1ccc(OC(F)F)c(/C=C/[N+](=O)[O-])c1	C10H9F2NO4	unknown
+COc1cc(F)c(C=O)cc1OC	C9H9FO3	unknown
+O=Cc1cc(O)c(O)cc1F	C7H5FO3	unknown
+O=Cc1cc2c(cc1F)OCO2	C8H5FO3	unknown
+C/C(=C\c1cc2c(cc1F)OCO2)[N+](=O)[O-]	C10H8FNO4	unknown
+Cc1c2ccccc2c(CCN)c2ccccc12	C17H17N	unknown
+CC(C)(NC(=O)c1cn(CCCCC#N)c2ncccc12)c1ccccc1	C22H24N4O	cannabinoid
+CC(C)(NC(=O)c1cn(CC2CCOCC2)c2ccccc12)c1ccc(F)cc1	C24H27FN2O2	cannabinoid
+CCCC(=O)N(c1ccccc1)C1CCN(CCc2ccccc2)CC1	C23H30N2O	fentanyl
+O=C(c1ccco1)N(c1ccc(F)cc1)C1CCN(CCc2ccccc2)CC1	C24H25FN2O2	fentanyl
+O=C(C1CC1)N(c1ccccc1)C1CCN(CCc2ccccc2)CC1	C23H28N2O	fentanyl
+O=C(C1CCC1)N(c1ccccc1)C1CCN(CCc2ccccc2)CC1	C24H30N2O	fentanyl
+CC1(C)C(C(=O)N(c2ccccc2)C2CCN(CCc3ccccc3)CC2)C1(C)C	C27H36N2O	fentanyl
+CCC(=O)N(c1ccc2c(c1)OCO2)C1CCN(CCc2ccccc2)CC1	C23H28N2O3	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CC(O)c2cccs2)CC1	C20H26N2O2S	fentanyl
+CCCC(=O)N(c1ccc(F)cc1)C1CCN(CC(O)c2cccs2)CC1	C21H27FN2O2S	fentanyl
+CCCC(=O)N(c1ccc(Cl)cc1)C1CCN(CCc2ccccc2)CC1	C23H29ClN2O	fentanyl
+CC(=O)N(c1ccc(F)cc1)C1CCN(CCc2ccccc2)CC1	C21H25FN2O	fentanyl
+CCC(=O)N(c1ccccc1)C1CC(C)N(CCc2ccccc2)CC1C	C24H32N2O	fentanyl
+C=CCC1CN(CCc2ccccc2)CCC1N(C(=O)CC)c1ccccc1	C25H32N2O	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CC(C)c2ccccc2)CC1	C23H30N2O	fentanyl
+CCC(=O)N(c1ccc(F)cc1)C1CCN(CC(O)c2ccccc2)CC1	C22H27FN2O2	fentanyl
+CCC(=O)N(c1ccc(F)cc1)C1CCN(C(C)Cc2ccccc2)CC1	C23H29FN2O	fentanyl
+CCC(=O)N(c1ccc(C)cc1)C1CCN(CCc2ccccc2)CC1	C23H30N2O	fentanyl
+CCC(=O)N(c1ccccc1)C1(C)CCN(CC(O)c2ccccc2)CC1	C23H30N2O2	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CCc2ccco2)CC1	C20H26N2O2	fentanyl
+CCn1nnn(CCN2CCC(N(C(=O)COC)c3ccccc3F)C(C)C2)c1=O	C20H29FN6O3	fentanyl
+CCC(=O)N(c1ccccc1F)C1(c2ccccc2)CCN(CCn2nnn(CC)c2=O)CC1	C25H31FN6O2	fentanyl
+O=C(c1ccco1)N(c1cnccn1)C1CCN(CCc2ccccc2)CC1	C22H24N4O2	fentanyl
+CCC(=O)N(c1ccccc1)C1(COC)CCN(CCc2ccccc2)CC1	C24H32N2O2	fentanyl
+CCC(=O)N(c1ccccc1)C1(C(=O)OC)CCN(CCc2ccccc2)CC1C	C25H32N2O3	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(Cc2cccs2)CC1	C19H24N2OS	fentanyl
+CCCC(=O)N(c1ccccc1)C1CCN(CCc2ccccc2)CC1C	C24H32N2O	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CCCc2ccccc2)CC1	C23H30N2O	fentanyl
+CCCN1CCC(N(C(=O)CC)c2ccccc2)CC1	C17H26N2O	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CCC(C(=O)N2CCCC2)(c2ccccc2)c2ccccc2)CC1	C34H41N3O2	unknown
+CCCCCN1CCC(C(=O)CC)(c2cccc(O)c2)CC1	C19H29NO2	unknown
+CCCN1CCC(C(=O)OCC)(c2ccccc2)CC1	C17H25NO2	unknown
+C[C@H]1[C@H]2Cc3ccc(O)cc3[C@]1(C)CCN2CCc1cccs1	C20H25NOS	unknown
+C[C@H]1[C@H]2Cc3ccc(O)cc3[C@]1(C)CCN2CCc1ccc(F)cc1	C22H26FNO	unknown
+CCC(=O)C1(c2ccccc2)CCN(C/C=C/c2ccccc2)CC1	C23H27NO	unknown
+CCC(=O)OC1(c2ccccc2)CCN(CCC(=O)c2ccccc2)CC1	C23H27NO3	unknown
+C=CC(=O)N(c1ccccc1)C1CCN(C(C)Cc2ccccc2)CC1	C23H28N2O	fentanyl
+Cc1ccc(C2(N(C)C)CCC(=O)CC2)cc1	C15H21NO	arylcycloalkylamine
+COc1cc2c(cc1OC)C(CCc1ccc([N+](=O)[O-])cc1)N(C)CC2	C20H24N2O4	unknown
+CCC(=O)C(CC(C)N1CCCC1)(c1ccccc1)c1ccccc1	C23H29NO	unknown
+CCS(=O)(=O)C(CC(C)N1CCCCC1)(c1ccccc1)c1ccccc1	C23H31NO2S	unknown
+CCC(=O)N(c1ccccc1)C1(C(=O)OC)CCN(CC(O)c2ccccc2)CC1	C24H30N2O4	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CC(O)c2ccc(Br)cc2)CC1C	C23H29BrN2O2	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CC(O)c2cccnc2)CC1C	C22H29N3O2	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CC(O)c2cccn2C)CC1C	C22H31N3O2	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CC(O)C2CC2)CC1C	C20H30N2O2	fentanyl
+CCC(=O)N(c1cccc(OC)c1)C1CCN(CC(O)c2ccccc2)CC1C	C24H32N2O3	fentanyl
+CCC(=O)N(c1cccc(OC)c1)C1CCN(CC(O)c2cccs2)CC1C	C22H30N2O3S	fentanyl
+CCC(=O)N(c1ccccc1F)C1CCN(CC(O)c2ccccc2)CC1C	C23H29FN2O2	fentanyl
+CCC(=O)N(c1cccc(F)c1)C1CCN(CC(O)c2ccccc2)CC1C	C23H29FN2O2	fentanyl
+CCC(=O)N(c1ccc(F)cc1)C1CCN(CC(O)c2ccccc2)CC1C	C23H29FN2O2	fentanyl
+COCC(=O)N(c1ccccc1)C1CCN(CC(O)c2ccccc2)CC1C	C23H30N2O3	fentanyl
+CCOC(=O)N(c1ccccc1)C1CCN(CC(O)c2ccccc2)CC1C	C23H30N2O3	fentanyl
+CC1CN(CC(O)c2ccccc2)CCC1N(C(=O)c1ccco1)c1ccccc1	C25H28N2O3	fentanyl
+CC1CN(CC(O)c2ccccc2)CCC1N(C(=O)c1ccoc1)c1ccccc1	C25H28N2O3	fentanyl
+CC1CN(CC(O)c2ccccc2)CCC1N(C(=O)c1cccs1)c1ccccc1	C25H28N2O2S	fentanyl
+CC1CN(CC(O)c2ccccc2)CCC1N(C(=O)c1ccsc1)c1ccccc1	C25H28N2O2S	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN([C@@H]2Cc3ccccc3C[C@H]2O)CC1C	C25H32N2O2	fentanyl
+CCC(=O)N(c1ccccn1)C1CCN(CC(O)c2ccccc2)CC1C	C22H29N3O2	fentanyl
+CCC(=O)N(c1cccnc1)C1CCN(CC(O)c2ccccc2)CC1C	C22H29N3O2	fentanyl
+CCC(=O)N(c1ccccc1)C1(C(=O)OC)CCN(CC(O)c2ccccc2)CC1C	C25H32N2O4	fentanyl
+CCOC(=O)C1(N(C(=O)CC)c2ccccc2)CCN(CC(O)c2ccccc2)CC1C	C26H34N2O4	fentanyl
+CCC(=O)N(c1ccccc1)C1(COC)CCN(CC(O)c2ccccc2)CC1C	C25H34N2O3	fentanyl
+CCC(=O)N(c1ccccc1F)C1(c2ccccc2)CCN(CCc2ccccc2)CC1	C28H31FN2O	fentanyl
+CCC(=O)N(c1ccccc1)C1(c2ccccc2)CCN(CCc2cccs2)CC1	C26H30N2OS	fentanyl
+CCC(=O)N(c1ccccc1F)C1(c2ccccc2)CCN(CCc2cccs2)CC1	C26H29FN2OS	fentanyl
+CCC(=O)N(c1ccccc1)C1(c2ccccc2)CCN(CCc2ccsc2)CC1	C26H30N2OS	fentanyl
+CCC(=O)N(c1ccccc1F)C1(c2ccccc2)CCN(CCc2ccsc2)CC1	C26H29FN2OS	fentanyl
+CCC(=O)N(c1ccccc1)C1(c2ccccc2)CCN(CCn2cccn2)CC1	C25H30N4O	fentanyl
+CCC(=O)N(c1ccccc1)C1(c2ccccc2)CCN(CCc2ccccn2)CC1	C27H31N3O	fentanyl
+CCC(=O)N(c1ccccc1F)C1(c2ccccc2)CCN(CCc2scnc2C)CC1	C26H30FN3OS	fentanyl
+CCC(=O)N(c1ccccc1F)C1(c2ccccc2)CCN(CCn2nc(C)cc2C)CC1	C27H33FN4O	fentanyl
+CCC(=O)N(c1ccccc1F)C1(c2ccccn2)CCN(CCc2ccccc2)CC1	C27H30FN3O	fentanyl
+CCC(=O)N(c1ccccc1F)C1(c2ccccn2)CCN(CCn2cccn2)CC1	C24H28FN5O	fentanyl
+CCC(=O)N(c1ccccc1)C1(c2nccs2)CCN(CCc2ccccc2)CC1	C25H29N3OS	fentanyl
+CCC(=O)N(c1ccccc1F)C1(c2nccs2)CCN(CCc2ccccc2)CC1	C25H28FN3OS	fentanyl
+CCC(=O)N(c1ccccc1F)C1(c2nccs2)CCN(CCn2nnn(CC)c2=O)CC1	C22H28FN7O2S	fentanyl
+CCC(=O)N(c1ccccc1F)C1(c2nc(C)cs2)CCN(CCc2ccsc2)CC1	C24H28FN3OS2	fentanyl
+CCC(=O)N(c1ccccc1F)C1(c2nc(C)cs2)CCN(CCn2cccn2)CC1	C23H28FN5OS	fentanyl
+CCC(=O)N(c1ccccc1F)C1(c2nc(C)cs2)CCN(CCc2scnc2C)CC1	C24H29FN4OS2	fentanyl
+CCC(=O)C(c1ccc(F)cc1)C1CCN(CCc2ccco2)CC1	C21H26FNO2	fentanyl
+COc1cc(O)cc(OC)c1C=O	C9H10O4	unknown
+COc1cc(OC(F)F)cc(OC)c1C=O	C10H10F2O4	unknown
+COc1cc(OC(F)F)cc(OC)c1/C=C/[N+](=O)[O-]	C11H11F2NO5	unknown
+COc1cc(OC(F)F)cc(OC)c1/C=C(\C)[N+](=O)[O-]	C12H13F2NO5	unknown
+COc1cc2c(c(OC)c1OC)CC2CN	C12H17NO3	unknown
+COc1cc(CCN)c2c(c1O)SSSSS2	C9H11NO2S5	unknown
+CN1CC[C@]23CCC[C@H]2[C@H]1Cc1ccc(O)cc13	C16H21NO	unknown
+CCC(=O)OC1(c2cccc(O)c2)C2CN(C)CC1CN(C)C2	C18H26N2O3	unknown
+Oc1cccc(CC(c2ccccc2)N2CCN(C3CCCCCC3)CC2)c1	C25H34N2O	unknown
+COc1ccccc1N1CCN([C@@H](Cc2cccc(O)c2)c2ccccc2)CC1	C25H28N2O2	unknown
+CCOC(=O)OCC1(N(C(=O)CC)c2ccccc2)CCN(CCc2cccs2)CC1	C24H32N2O4S	fentanyl
+CN(C)C[C@H]1CCCC[C@]1(F)c1cccc(O)c1	C15H22FNO	unknown
+CC[C@@H](C)N(C[C@H](O)[C@@H]1CCC(=O)N1Cc1ccccc1Cl)[C@H](C)CC	C21H33ClN2O2	unknown
+C[C@H]1[C@H]2Cc3scnc3[C@]1(C)CCN2C	C12H18N2S	unknown
+CCN(CC)CCn1c(Cc2ccc(Cl)cc2)nc2cc([N+](=O)[O-])ccc21	C20H23ClN4O2	unknown
+CCOc1ccc(Cc2nc3cc([N+](=O)[O-])ccc3n2CCN(CC)CC)cc1	C22H28N4O3	unknown
+CCC(=O)n1c(=O)n(C2CCN(CCC(C#N)(c3ccccc3)c3ccccc3)CC2)c2ccccc21	C31H32N4O2	unknown
+CCN(CC)CCn1c(Cc2ccc(OC)cc2)nc2cc([N+](=O)[O-])ccc21	C21H26N4O3	unknown
+N#CC(CCN1CCC(n2c(=O)[nH]c3ccccc32)CC1)(c1ccccc1)c1ccccc1	C28H28N4O	unknown
+CCC(=O)N(CC(C)N(C)CCc1ccccc1)c1ccccc1	C21H28N2O	unknown
+CCC(=O)N(c1ccccc1)C(C)CN1CCCCC1	C17H26N2O	unknown
+CCC(=O)N(c1ccccn1)C(C)CN1CCCCC1	C16H25N3O	unknown
+CCN(CC)C(C)C=C(c1cccs1)c1cccs1	C16H21NS2	unknown
+CC(C=C(c1cccs1)c1cccs1)N(C)C	C14H17NS2	unknown
+CCN(C)C(C)C=C(c1cccs1)c1cccs1	C15H19NS2	unknown
+CC(C=C(c1cccs1)c1cccs1)N1CCCC1	C16H19NS2	unknown
+CC(C=C(c1cccs1)c1cccs1)N1CCCCC1	C17H21NS2	unknown
+CC(=O)OC1(c2ccc(Cl)cc2)CCN(CCC(C(=O)N(C)C)(c2ccccc2)c2ccccc2)CC1	C31H35ClN2O3	unknown
+CCC(=O)OC1(c2ccc(Cl)cc2)CCN(CCC(C(=O)N(C)C)(c2ccccc2)c2ccccc2)CC1	C32H37ClN2O3	unknown
+CCC(=O)OC1(c2ccccc2)CCN(CCC(C(=O)N(C)C)(c2ccccc2)c2ccccc2)CC1	C32H38N2O3	unknown
+CCC(=O)OC1(c2ccc(Cl)cc2)CCN(CCCC(=O)c2ccc(F)cc2)CC1	C24H27ClFNO3	unknown
+CCC(=O)OC1(c2ccccc2)CCN(CCCC(=O)c2ccc(F)cc2)CC1	C24H28FNO3	unknown
+CCC(=O)C(CCN1CCC2(CCCc3ccccc32)CC1)(c1ccccc1)c1ccccc1	C32H37NO	unknown
+CCC(=O)OC1(c2ccccc2)CCN(CC=C2c3ccccc3CCc3ccccc32)CC1	C31H33NO2	unknown
+CN1CCC(C(=O)OC23CC4CC(CC(C4)C2)C3)(c2ccccc2)CC1	C23H31NO2	unknown
+CN1CC[C@]2(c3cccc(O)c3)CCCC[C@H]2C1	C16H23NO	unknown
+Oc1cccc([C@@]23CCCC[C@H]2CN(CCc2ccccc2)CC3)c1	C23H29NO	unknown
+C=C1CC[C@H]2CN(C)CC[C@]2(c2cccc(O)c2)C1	C17H23NO	unknown
+CCCN(C(=O)C(C)C1(O)CCN(CCc2ccccc2Cl)CC1)c1ccccc1OC	C26H35ClN2O3	unknown
+CC[C@@]12CCN(CCc3ccccc3)C[C@@H]1Oc1ccc(O)cc12	C21H25NO2	unknown
+O=C1CC[C@H]2CN(CC3CC3)CC[C@@]23c2cccc(O)c2O[C@@H]13	C19H23NO3	unknown
+COc1c(OC)c2c(c(CCN(C)C)c1SC)Sc1c(OC)c(OC)c(SC)c(CCN(C)C)c1S2	C26H38N2O4S4	unknown
+COc1c(OC)c2c(c(CCN(C)C)c1SC)Sc1c(CCN(C)C)c(SC)c(OC)c(OC)c1S2	C26H38N2O4S4	unknown
+COc1c(SC)c(CCN(C)C)c2sc3c(CCN(C)C)c(SC)c(OC)c(OC)c3ssc2c1OC	C26H38N2O4S5	unknown
+COc1c(SC)c(CCN(C)C)c2ssc3c(CCN(C)C)c(SC)c(OC)c(OC)c3sc3c(OC)c(OC)c(SC)c(CCN(C)C)c3sc2c1OC	C39H57N3O6S7	unknown
+COc1c(SC)c(CCN(C)C)c2sc3c(OC)c(OC)c(SC)c(CCN(C)C)c3ssc2c1OC	C26H38N2O4S5	unknown
+CN1CCCCCC1n1cc(C(=O)C2C(C)(C)C2(C)C)c2ccccc21	C23H32N2O	cannabinoid
+COC(=O)c1cn(CCCCCF)c2ccccc12	C15H18FNO2	cannabinoid
+CCCC(F)Cn1cc(C(=O)Nc2cccc3ccccc23)c2ccccc21	C24H23FN2O	cannabinoid
+CC(F)CCCn1cc(C(=O)Nc2cccc3ccccc23)c2ccccc21	C24H23FN2O	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1cc(-c2ccc(F)cc2)nn1CCCCCF)C(N)=O	C21H28F2N4O2	cannabinoid
+CC(C)[C@H](NC(=O)c1cc(-c2ccc(F)cc2)nn1CCCCCF)C(N)=O	C20H26F2N4O2	cannabinoid
+CC(O)CCCn1cc(C(=O)C2C(C)(C)C2(C)C)c2ccccc21	C21H29NO2	cannabinoid
+O=C(C1=CCCC1)N(c1ccccc1)C1CCN(CCc2ccccc2)CC1	C25H30N2O	fentanyl
+O=C(c1ccco1)N(c1ccc(Cl)cc1)C1CCN(CCc2ccccc2)CC1	C24H25ClN2O2	fentanyl
+CC(C)c1ccccc1N(C(=O)c1ccco1)C1CCN(CCc2ccccc2)CC1	C27H32N2O2	fentanyl
+Fc1cccc(N2CCNCC2)c1	C10H13FN2	unknown
+CN1C(=O)CN=C(c2ccccc2F)c2cc(N)ccc21	C16H14FN3O	aryldiazepine
+O=C(C1CCCCC1)N(c1ccccc1)C1CCN(CCc2ccccc2)CC1	C26H34N2O	fentanyl
+CC(C)C(=O)N(c1ccccc1F)C1CCN(CCc2ccccc2)CC1	C23H29FN2O	fentanyl
+Fc1ccccc1N1CCNCC1	C10H13FN2	unknown
+O=C1CN=C(c2ccccc2)c2cc(Br)ccc2N1	C15H11BrN2O	aryldiazepine
+COc1ccccc1CN(C)C(C)Cc1ccc(C)cc1	C19H25NO	unknown
+CCC(NC)c1ccccc1	C10H15N	unknown
+Cc1ccc(C(=O)C(C)N2CCCCC2)cc1	C15H21NO	beta-ketone
+COc1cc(CCNCc2ccc(O)cc2OC)c(OC)cc1I	C18H22INO4	unknown
+CCOC(=O)N1CCC(=O)N(c2ccccc2)c2cc(Cl)ccc21	C18H17ClN2O3	aryldiazepine
+CN1C(=O)CN(C(N)=O)C(c2ccccc2)c2cc(Cl)ccc21	C17H16ClN3O2	aryldiazepine
+CN1C(=O)CN2CCc3ccccc3C2c2cc(Cl)ccc21	C18H17ClN2O	aryldiazepine
+Cc1ncc2n1-c1ccc(Cl)cc1C(c1ccccc1Cl)=NC2	C18H13Cl2N3	aryldiazepine
+NC1=Nc2ccc([N+](=O)[O-])cc2N(c2ccccc2)C(=O)C1	C15H12N4O3	aryldiazepine
+[O-][N+]1=C(c2ccccc2)c2cc(Cl)ccc2N=C(NCC2CC2)C1	C19H18ClN3O	aryldiazepine
+O=[N+]([O-])c1ccc2c(c1)C(c1ccccc1)=NCc1nncn1-2	C16H11N5O2	aryldiazepine
+Clc1ccc2c(c1)C(c1ccccc1Cl)=NCc1nncn1-2	C16H10Cl2N4	aryldiazepine
+O=C1C(O)N=C(c2ccccc2F)c2cc(Cl)ccc2N1CCO	C17H14ClFN2O3	aryldiazepine
+CCS(=O)(=O)CCN1C(=O)CN=C(c2ccccc2F)c2cc(Cl)ccc21	C19H18ClFN2O3S	aryldiazepine
+CCOC(=O)C1N=C(c2ccccc2F)c2cc(Cl)ccc2N(C(=O)NC)C1=O	C20H17ClFN3O4	aryldiazepine
+CCOC(=O)C1N=C(c2ccccc2Cl)c2cc(Cl)ccc2NC1=O	C18H14Cl2N2O3	aryldiazepine
+CN(C)Cc1nc(-c2ncn3c2CN(C)C(=O)c2c(Cl)cccc2-3)no1	C17H17ClN6O2	aryldiazepine
+Fc1ccccc1C1=NCCN(CC(F)(F)F)c2ccc(Cl)cc21	C17H13ClF4N2	aryldiazepine
+CN(C)Cc1nnc2n1-c1ccc(Cl)cc1C(c1ccccc1F)=NC2	C19H17ClFN5	aryldiazepine
+Cc1nnc2n1-c1sc(Br)cc1C(c1ccccc1F)=NC2	C15H10BrFN4S	aryldiazepine
+CCc1cc2c(s1)-n1c(C)nnc1CN=C2c1ccccc1F	C17H15FN4S	aryldiazepine
+CN1CCN(/C=C2\N=C3CN=C(c4ccccc4F)c4cc([N+](=O)[O-])ccc4N3C2=O)CC1	C23H21FN6O3	aryldiazepine
+CN1C(=O)C(O)N=C(c2ccccc2F)c2cc(Cl)ccc21	C16H12ClFN2O2	aryldiazepine
+Cc1nnc2n1-c1ccc(Cl)cc1C(c1ccccc1F)=NC2	C17H12ClFN4	aryldiazepine
+CP(C)(=O)CN1C(=O)CN=C(c2ccccc2)c2cc(Cl)ccc21	C18H18ClN2O2P	aryldiazepine
+NNC(=O)CN1C(=O)CN=C(c2ccccc2)c2cc(Br)ccc21	C17H15BrN4O2	aryldiazepine
+O=C1CN=C(c2ccccc2)c2cc(Cl)ccc2N1CCOCC1CC1	C21H21ClN2O2	aryldiazepine
+NC(=O)c1ncn2c1CN=C(c1ccccc1Br)c1cc(F)ccc1-2	C18H12BrFN4O	aryldiazepine
+CCOC(=O)c1ncn2c1CN(C)C(=O)c1c(I)cccc1-2	C15H14IN3O3	aryldiazepine
+CCOC(=O)c1ncn2c1[C@@H]1CCCN1C(=O)c1cc(OC)ccc1-2	C18H19N3O4	aryldiazepine
+O=C1CCNc2ccc(Cl)cc2N1c1ccccc1	C15H13ClN2O	aryldiazepine
+O=C1Nc2ccc(Cl)nc2C(c2ccccc2Cl)=NC1O	C14H9Cl2N3O2	aryldiazepine
+CN1C(=O)CN=C(C2=CCCCC2)c2cc([N+](=O)[O-])ccc21	C16H17N3O3	aryldiazepine
+COCC1CN=C(c2ccccc2Cl)c2cc(Br)ccc2N1C	C18H18BrClN2O	aryldiazepine
+CN1C(=O)CN=C(c2ccccn2)c2cc(Br)ccc21	C15H12BrN3O	aryldiazepine
+CC1COC2(c3ccccc3Cl)c3cc(Cl)ccc3NC(=O)CN12	C18H16Cl2N2O2	aryldiazepine
+Cc1nnc2n1-c1ccc(Br)cc1C(c1ccccc1Cl)=NC2	C17H12BrClN4	aryldiazepine
+COCc1ncn2c1CN(C)C(=O)c1cc(Cl)ccc1-2	C14H14ClN3O2	aryldiazepine
+C#Cc1ccc2c(c1)C(c1ccccn1)=NCc1nnc(C)n1-2	C18H13N5	aryldiazepine
+Cc1nnc2n1-c1ccc([N+](=O)[O-])cc1C(c1ccccn1)=NC2	C16H12N6O2	aryldiazepine
+C#Cc1ccc2c(c1)C(c1ccccc1)=NCC(=O)N2C	C18H14N2O	aryldiazepine
+O=C1COC(N2CCN=C(c3ccccc3Cl)c3cc(Cl)ccc32)=N1	C18H13Cl2N3O2	aryldiazepine
+CCn1nc(C)c2c1C(c1ccccc1)=NCC(=O)N2	C15H16N4O	aryldiazepine
+O=C1CN=C(c2ccccc2F)c2cc(I)ccc2N1	C15H10FIN2O	aryldiazepine
+CCOC(=O)c1ncn2c1CN(C)C(=O)c1cc(N=[N+]=[N-])ccc1-2	C15H14N6O3	aryldiazepine
+CCCN(CCC)Cc1nc(-c2ncn3c2CN(C)C(=O)c2cc(F)ccc2-3)no1	C21H25FN6O2	aryldiazepine
+CCCN(CCC)Cc1cnc(-c2ncn3c2CN(C)C(=O)c2cc(F)ccc2-3)o1	C22H26FN5O2	aryldiazepine
+FC(F)c1ncn2c1Cn1ncnc1-c1cc(Br)ccc1-2	C13H8BrF2N5	aryldiazepine
+CCOC(=O)c1ncn2c1CN(C)C(=O)c1c(Cl)cccc1-2	C15H14ClN3O3	aryldiazepine
+C#Cc1ccc2c(c1)C(c1ccccc1F)=N[C@H](C)c1c(C(=O)OCC)ncn1-2	C23H18FN3O2	aryldiazepine
+C#Cc1ccc2c(c1)C(c1ccccc1F)=N[C@H](C)c1c(C(=O)NC)ncn1-2	C22H17FN4O	aryldiazepine
+CN1C(=S)CN=C(c2ccccc2)c2cc(Cl)ccc21	C16H13ClN2S	aryldiazepine
+Cc1ccc(S(=O)(=O)CCN2C(=O)CN=C(c3ccccc3Cl)c3cc(Cl)ccc32)cc1	C24H20Cl2N2O3S	aryldiazepine
+CN1C(=O)CC(=O)N(c2ccccc2)c2cc(C(F)(F)F)ccc21	C17H13F3N2O2	aryldiazepine
+CN1c2ccc(Cl)cc2C(c2ccccc2Cl)=NCC1CO	C17H16Cl2N2O	aryldiazepine
+C=CCONC1=Nc2ccc(Cl)cc2C(c2ccccc2Cl)=NC1	C18H15Cl2N3O	aryldiazepine
+Clc1ccc2c(n1)C(c1ccccc1Cl)=NCc1nncn1-2	C15H9Cl2N5	aryldiazepine
+Cc1nn(C)c2c1N(c1ccccc1)C(=O)CC(=O)N2C	C15H16N4O2	aryldiazepine
+CN1C(=O)CN=C(c2ccccc2F)c2cc(F)ccc21	C16H12F2N2O	aryldiazepine
+CN1C(=O)CN=C(c2c(F)cccc2F)c2cc(Cl)ccc21	C16H11ClF2N2O	aryldiazepine
+CN1C(=O)CN=C(c2c(Cl)cccc2Cl)c2cc(Cl)ccc21	C16H11Cl3N2O	aryldiazepine
+O=C1CN=C(c2ccccc2C(F)(F)F)c2cc([N+](=O)[O-])ccc2N1	C16H10F3N3O3	aryldiazepine
+C=Cc1ccc2c(c1)C(c1ccccc1)=NCC(=O)N2	C17H14N2O	aryldiazepine
+CN1C(=O)CN=C(c2ccccc2F)c2cc(C#N)ccc21	C17H12FN3O	aryldiazepine
+O=C1CN=C(c2ccccc2)c2cc(C(F)(F)F)ccc2N1	C16H11F3N2O	aryldiazepine
+Clc1ccccc1C1=NCc2nnc(C3CCCCC3)n2-c2sc(Br)cc21	C20H18BrClN4S	aryldiazepine
+O=C1CN=C(c2ccccc2Cl)c2cc(Cl)sc2N1	C13H8Cl2N2OS	aryldiazepine
+CN1C(=O)CN=C(c2ccccc2Cl)c2ccccc21	C16H13ClN2O	aryldiazepine
+CCCCn1cc(C(=O)Cc2cccc3ccccc23)c2cccc(OC)c21	C25H25NO2	cannabinoid
+Cc1[nH]nc2c1N(c1ccccc1)C(=O)CC(=O)N2C	C14H14N4O2	aryldiazepine
+CC1=C2C(c3cccc(Cl)c3)=NCCN=C2N(C)N1	C14H15ClN4	aryldiazepine
+CC1Cc2cc3c(cc2C(c2ccc(N)cc2)=NN1)OCO3	C17H17N3O2	aryldiazepine
+Cc1nnc2n1-c1sc(CCc3ccc(CC(C)C)cc3)cc1C(c1ccccc1F)=N[C@@H]2C	C28H29FN4S	aryldiazepine
+Cc1sc2c(c1C)C(c1ccc(Cl)cc1)=N[C@@H](CC(=O)OC(C)(C)C)c1nnc(C)n1-2	C23H25ClN4O2S	aryldiazepine
+O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)c1cc2ccccc2[nH]1	C24H18N4O2	aryldiazepine
+CCOC(=O)c1ncn2c1[C@@H]1CCCN1C(=O)c1c(Cl)cccc1-2	C17H16ClN3O3	aryldiazepine
+Cc1cc(-c2cccc(C3=Nc4cc(C)c(C(F)(F)F)cc4NC(=O)C3)c2)cc(C)n1	C24H20F3N3O	aryldiazepine
+CN1c2ccccc2C(c2ccccc2F)=NCC1CNC(=O)c1ccsc1	C22H20FN3OS	aryldiazepine
+O=C(OCC1CC1)c1ncn2c1[C@@H]1CCN1C(=O)c1c(Cl)cccc1-2	C18H16ClN3O3	aryldiazepine
+Cc1nnc2n1-c1ccc([N+](=O)[O-])cc1C(c1ccccc1Cl)=CC2	C18H13ClN4O2	aryldiazepine
+NC(=O)c1ncn2c1CN=C(c1ccccc1F)c1cc(Cl)ccc1-2	C18H12ClFN4O	aryldiazepine
+CC(C)[C@H](NC(=O)c1cn(Cc2ccc(F)cc2)c2ncccc12)C(N)=O	C20H21FN4O2	cannabinoid
+CCCCCn1cc(C(=O)Cc2cccc3ccccc23)c2ccccc21	C25H25NO	cannabinoid
+CC(C)(c1ccccc1)n1ccc2c(c1=O)c1ccccc1n2CCCCCF	C25H27FN2O	cannabinoid
+CC(C)[C@H](NC(=O)c1c2ccccc2nn1CC1CCCCC1)C(N)=O	C20H28N4O2	cannabinoid
+CC(C)[C@H](NC(=O)c1c2ccccc2nn1Cc1ccc(F)cc1)C(N)=O	C20H21FN4O2	cannabinoid
+CCCCCn1nc2ccccc2c1C(=O)N[C@H](C(N)=O)C(C)C	C18H26N4O2	cannabinoid
+CC(C)[C@H](NC(=O)c1c2ccccc2nn1CCCCCF)C(N)=O	C18H25FN4O2	cannabinoid
+COc1cc(CCN)c(OC(C)C)cc1Br	C12H18BrNO2	unknown
+COc1ccc(OC(C)C)cc1CCN	C12H19NO2	unknown
+CCC(=O)N(c1ccccc1)C1CCN(CCc2ccccc2)CC1C(=O)OC	C24H30N2O3	fentanyl
+O=C(CCc1ccccc1)N(c1ccccc1)C1CCN(CCc2ccccc2)CC1	C28H32N2O	fentanyl
+COc1ccc(N(C(C)=O)C2CCN(CCc3ccccc3)CC2)cc1	C22H28N2O2	fentanyl
+O=C(c1ccccc1)N(c1ccccc1)C1CCN(CCc2ccccc2)CC1	C26H28N2O	fentanyl
+CCC(=O)N(c1ccccc1)C1(C)CCN(CCc2ccccc2)CC1	C23H30N2O	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CCc2ccccc2)CC1CC	C24H32N2O	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CCc2ccccc2)CC1OC	C23H30N2O2	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CCc2ccccc2)CC1(C)C	C24H32N2O	fentanyl
+CCC(=O)N(c1ccccc1)C1C(C)CN(CCc2ccccc2)CC1C	C24H32N2O	fentanyl
+CCC(=O)N(c1ccc(Br)cc1)C1CCN(CCc2ccccc2)CC1	C22H27BrN2O	fentanyl
+CCC(=O)N(c1ccc(C(F)(F)F)cc1)C1CCN(CCc2ccccc2)CC1	C23H27F3N2O	fentanyl
+CCC(=O)N(c1ccc(F)cc1)C1CCN(CCc2cccs2)CC1	C20H25FN2OS	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CCc2ccc([N+](=O)[O-])cc2)CC1	C22H27N3O3	fentanyl
+CC(=O)N(c1ccccc1)C1CCN(CCc2ccc(C)cc2)CC1	C22H28N2O	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CCc2ccc(C)cc2)CC1	C23H30N2O	fentanyl
+CCC(=O)N(c1ccc(Cl)c(Cl)c1)C1CCN(CCc2cccc(F)c2)CC1	C22H25Cl2FN2O	fentanyl
+CCC(=O)N(c1ccccc1)C1(C(=O)OC)CCN(CCn2cccc2)CC1	C22H29N3O3	fentanyl
+CCC(=O)N(c1ccccc1)C1(C(=O)OC)CCN(CCn2cccn2)CC1	C21H28N4O3	fentanyl
+CCC(=O)N(c1ccccc1)C1(C(=O)OC)CCN(CCSc2nccn2C)CC1	C22H30N4O3S	fentanyl
+CCC(=O)N(c1ccccc1)C1(C(=O)OC)CCN(CCn2ncnn2)CC1	C19H26N6O3	fentanyl
+CCC(=O)N(c1ccccc1)C1(C(=O)OC)CCN(CC(=O)c2cccs2)CC1	C22H26N2O4S	fentanyl
+CCC(=O)N(c1ccccc1)C1(C(=O)OC)CCN(CC(O)c2cccs2)CC1	C22H28N2O4S	fentanyl
+CCC(=O)N(c1ccccc1)C1(COC)CCN(CC(O)c2ccco2)CC1	C22H30N2O4	fentanyl
+CCC(=O)N(c1ccccc1)C1(C(=O)OC)CCN(CCc2scnc2C)CC1	C22H29N3O3S	fentanyl
+CCC(=O)N(c1ccccc1)C1(C(=O)OC)CCN(CCn2c(SC)ncc(C)c2=O)CC1	C24H32N4O4S	fentanyl
+CCC(=O)N(c1ccccc1)C1(C(=O)OC)CCN(CCN2C(=O)Cc3ccccc32)CC1	C26H31N3O4	fentanyl
+CCC(=O)N(c1ccccc1)C1(C(=O)OC)CCN(CCn2c(=O)oc3ccccc32)CC1	C25H29N3O5	fentanyl
+CCC(=O)N(c1ccccc1)C1(C(=O)OC)CCN(CC2COc3ccccc3O2)CC1	C25H30N2O5	fentanyl
+CCC(=O)N(c1ccccc1)C1(C(=O)OC)CCN(CCN2C(=O)CSc3ccccc32)CC1	C26H31N3O4S	fentanyl
+CCC(=O)N(c1cccc(C)c1)C1CCN(CCc2ccccc2)CC1	C23H30N2O	fentanyl
+CCC(=O)N(c1ccc(I)cc1)C1CCN(CCc2ccccc2)CC1	C22H27IN2O	fentanyl
+C/C=C/C(=O)N(c1ccccc1)C1CCN(CCc2ccccc2)CC1	C23H28N2O	fentanyl
+C/C=C/C(=O)N(c1ccc(F)cc1)C1CCN(CCc2ccccc2)CC1	C23H27FN2O	fentanyl
+O=C(c1ccoc1)N(c1ccccc1)C1CCN(CCc2ccccc2)CC1	C24H26N2O2	fentanyl
+CCCC(=O)N(c1ccccc1F)C1CCN(CCc2ccccc2)CC1	C23H29FN2O	fentanyl
+Cc1ccc(N(C(=O)c2ccco2)C2CCN(CCc3ccccc3)CC2)cc1	C25H28N2O2	fentanyl
+O=C(C1CC1)N(c1ccc(F)cc1)C1CCN(CCc2ccccc2)CC1	C23H27FN2O	fentanyl
+O=C(c1ccoc1)N(c1ccc(F)cc1)C1CCN(CCc2ccccc2)CC1	C24H25FN2O2	fentanyl
+O=C(C1CCCO1)N(c1ccc(F)cc1)C1CCN(CCc2ccccc2)CC1	C24H29FN2O2	fentanyl
+Cc1ccccc1N(C(=O)c1ccco1)C1CCN(CCc2ccccc2)CC1	C25H28N2O2	fentanyl
+O=C(c1cccs1)N(c1ccccc1)C1CCN(CCc2ccccc2)CC1	C24H26N2OS	fentanyl
+O=C(Cc1ccccc1)N(c1ccccc1)C1CCN(CCc2ccccc2)CC1	C27H30N2O	fentanyl
+COC(C)C(=O)N(c1ccccc1)C1CCN(CCc2ccccc2)CC1	C23H30N2O2	fentanyl
+CC1CCC(c2ccccc2)(N2CCCCC2)CC1	C18H27N	arylcycloalkylamine
+Cc1ccccc1N(C(=O)C1CC1)C1CCN(CCc2ccccc2)CC1	C24H30N2O	fentanyl
+CC(=O)N(c1ccccc1C)C1CCN(CCc2ccccc2)CC1	C22H28N2O	fentanyl
+CCOCC(=O)N(c1ccccc1)C1CCN(CCc2ccccc2)CC1	C23H30N2O2	fentanyl
+Cc1ccccc1N(C(=O)c1ccccc1)C1CCN(CCc2ccccc2)CC1	C27H30N2O	fentanyl
+O=C(C1CC1)N(c1ccc(Cl)cc1)C1CCN(CCc2ccccc2)CC1	C23H27ClN2O	fentanyl
+O=C(C1CCCC1)N(c1ccc(F)cc1)C1CCN(CCc2ccccc2)CC1	C25H31FN2O	fentanyl
+Cc1ccc(N(C(=O)C2CC2)C2CCN(CCc3ccccc3)CC2)cc1	C24H30N2O	fentanyl
+COCC(=O)N(c1ccc(Cl)cc1)C1CCN(CCc2ccccc2)CC1	C22H27ClN2O2	fentanyl
+O=C(C1CCCC1)N(c1ccc(Cl)cc1)C1CCN(CCc2ccccc2)CC1	C25H31ClN2O	fentanyl
+COCC(=O)N(c1ccc(OC)cc1)C1CCN(CCc2ccccc2)CC1	C23H30N2O3	fentanyl
+CC(=O)N(c1ccc(C)cc1)C1CCN(CCc2ccccc2)CC1	C22H28N2O	fentanyl
+CCCC(=O)N(c1cccc(F)c1)C1CCN(CCc2ccccc2)CC1	C23H29FN2O	fentanyl
+COc1ccc(N(C(=O)C2CCCO2)C2CCN(CCc3ccccc3)CC2)cc1	C25H32N2O3	fentanyl
+COc1ccc(N(C(=O)c2ccco2)C2CCN(CCc3ccccc3)CC2)cc1	C25H28N2O3	fentanyl
+COC(=O)C1(N(C(C)=O)c2ccccc2)CCN(CCc2ccccc2)CC1	C23H28N2O3	fentanyl
+CC(C)(C)C(=O)N(c1ccccc1)C1CCN(CCc2ccccc2)CC1	C24H32N2O	fentanyl
+C=C(C)C(=O)N(c1ccccc1)C1CCN(CCc2ccccc2)CC1	C23H28N2O	fentanyl
+CC(C)CC(=O)N(c1ccccc1)C1CCN(CCc2ccccc2)CC1	C24H32N2O	fentanyl
+CCC(=O)N(c1ccccc1)C(C)CCN(C)CCc1ccccc1	C22H30N2O	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CCc2ccc(OC)cc2)CC1	C23H30N2O2	fentanyl
+CCC(=O)N(c1ccc(OC)cc1)C1CCN(CCc2ccccc2)CC1	C23H30N2O2	fentanyl
+CC(C)C(=O)N(c1ccccc1)C1CCN(C(C)Cc2ccccc2)CC1	C24H32N2O	fentanyl
+CC(=O)N(c1ccccc1)C1CCN(C)CC1	C14H20N2O	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(C)CC1	C15H22N2O	fentanyl
+CC(=O)N(c1ccccc1)C1CCN(Cc2ccccc2)CC1	C20H24N2O	fentanyl
+CCCC(=O)N(c1ccccc1)C1CCN(Cc2ccccc2)CC1	C22H28N2O	fentanyl
+CCC(=O)N(c1ccccc1)C1(F)CCN(CCc2ccccc2)CC1	C22H27FN2O	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CCc2ccccc2)C(F)C1	C22H27FN2O	fentanyl
+O=C1Nc2ccc(Cl)cc2[C@@](C#CC2CC2)(C(F)(F)F)O1	C14H9ClF3NO2	unknown
+CN1c2ccccc2C(NCCCCCCC(=O)O)c2ccc(Cl)cc2S1(=O)=O	C21H25ClN2O4S	unknown
+CCOC(=O)N(c1ccccc1)C1CCN(CCc2ccccc2)CC1	C22H28N2O2	fentanyl
+CN(C)[C@]1(c2ccc(Br)cc2)CC[C@](O)(CCc2ccccc2)CC1	C22H28BrNO	arylcycloalkylamine
+C=CCC1CN(C)CCC1(OC(=O)CC)c1ccccc1	C18H25NO2	unknown
+CCCC(NC)C(=O)c1ccc(CC)cc1	C14H21NO	beta-ketone
+CCC(=O)O[C@@]1(c2ccccc2)CCN(C)C[C@H]1CC	C17H25NO2	unknown
+CC(C)C(NC(=O)c1nn(CCCCCF)c2ccccc12)c1ccccc1	C23H28FN3O	unknown
+CCC(=O)O[C@@]1(c2ccccc2)CCN(C)C[C@H]1C	C16H23NO2	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCc2ccc(N)cc2)CC1	C22H28N2O2	unknown
+CCC(=O)O[C@@]1(c2ccccc2)CCN(C)C[C@@H]1CC	C17H25NO2	unknown
+CCC(=O)O[C@@]1(c2ccccc2)CCN(C)C[C@@H]1C	C16H23NO2	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCOCc2ccccc2)CC1	C23H29NO3	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCC(C#N)(c2ccccc2)c2ccccc2)CC1	C30H32N2O2	unknown
+N#CC(CCN1CCC(C(=O)O)(c2ccccc2)CC1)(c1ccccc1)c1ccccc1	C28H28N2O2	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCOCCO)CC1	C18H27NO4	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCOCC2CCCO2)CC1	C21H31NO4	unknown
+CCOC(=O)C1(c2cccc(O)c2)CCN(C)CC1	C15H21NO3	unknown
+CCC(=O)C1(c2cccc(O)c2)CCN(C)CC1	C15H21NO2	unknown
+CN1CCC(C#N)(c2ccccc2)CC1	C13H16N2	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCN2CCOCC2)CC1	C20H30N2O3	unknown
+CCOC(=O)C1(c2ccccc2)CCNCC1	C14H19NO2	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCC(O)c2ccccc2)CC1	C23H29NO3	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCCNc2ccccc2)CC1	C23H30N2O2	unknown
+CC(C)OC(=O)C1(c2ccccc2)CCN(C)CC1	C16H23NO2	unknown
+CCC(=O)OC1(c2ccccc2)CC(C)N(C)CC1C	C17H25NO2	unknown
+CN1CCC(C(=O)O)(c2ccccc2)CC1	C13H17NO2	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCC(N)=O)CC1	C17H24N2O3	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CC(O)c2ccccc2)CC1	C22H27NO3	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCN2CCSCC2)CC1	C20H30N2O2S	unknown
+CCOC(=O)C1(c2ccccc2)CCN(C/C=C/c2ccc([N+](=O)[O-])cc2)CC1	C23H26N2O4	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCc2ccccc2)CC1	C22H27NO2	unknown
+CCC(=O)OC1(c2ccccc2)CCN(CCc2ccccc2)CC1	C22H27NO2	unknown
+CCC(=O)OC1(c2ccccc2)CCN(CCCc2ccccc2)CC1	C23H29NO2	unknown
+CC(=O)OC1(c2ccccc2)CCN(CCc2ccccc2)CC1	C21H25NO2	unknown
+CCOC(=O)C1(c2ccccc2)CCN(C/C=C/c2ccccc2)CC1	C23H27NO2	unknown
+CCC(=O)OC1(c2ccccc2)CCN(C/C=C/c2ccccc2)CC1	C23H27NO2	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCC(=O)c2ccccc2)CC1	C23H27NO3	unknown
+CCC(=O)OC(CCN1CCC(OC(=O)CC)(c2ccccc2)CC1)c1ccccc1	C26H33NO4	unknown
+CCC(=O)OC1(c2ccccc2)CCN(CC)CC1	C16H23NO2	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCc2ccncc2)CC1	C21H26N2O2	unknown
+CCOC(=O)C1(c2ccc(C)cc2)CCN(C)CC1	C16H23NO2	unknown
+CCOC(=O)C1(c2ccc(F)cc2)CCN(C)CC1	C15H20FNO2	unknown
+CCOC(=O)C1(c2ccc(Cl)c(Cl)c2)CCN(C)CC1	C15H19Cl2NO2	unknown
+C=CCN1CCC(C(=O)OCC)(c2ccccc2)CC1	C17H23NO2	unknown
+CCCCCCN1CCC(C(=O)N(C)CC)(c2ccccc2)CC1	C21H34N2O	unknown
+CCOCCN1CCC(OC(=O)CC)(c2ccccc2)CC1	C18H27NO3	unknown
+CCC(=O)C1(c2ccccc2)CCN(CCOCCO)CC1	C18H27NO3	unknown
+CCCC1(c2cccc(O)c2)CCN(C)CC1C	C16H25NO	unknown
+Brc1cccc(C2(N3CCCCC3)CCCCC2)c1	C17H24BrN	arylcycloalkylamine
+Fc1cccc(C2(N3CCCCC3)CCCCC2)c1	C17H24FN	arylcycloalkylamine
+Cc1cccc(C2(N3CCCCC3)CCCCC2)c1	C18H27N	arylcycloalkylamine
+Clc1ccc(C2(N3CCCCC3)CCCCC2)cc1	C17H24ClN	arylcycloalkylamine
+Nc1cccc(C2(N3CCCCC3)CCCCC2)c1	C17H26N2	arylcycloalkylamine
+Fc1ccc(C2(N3CCCCC3)CCCCC2)cc1	C17H24FN	arylcycloalkylamine
+Oc1ccc(C2(N3CCCCC3)CCCCC2)cc1	C17H25NO	arylcycloalkylamine
+O=[N+]([O-])c1ccc(C2(N3CCCCC3)CCCCC2)cc1	C17H24N2O2	arylcycloalkylamine
+O=C1CCCCC1(c1ccccc1)N1CCCCC1	C17H23NO	arylcycloalkylamine
+CC1(C)CCN(C2(c3ccccc3)CCCCC2)C1	C18H27N	arylcycloalkylamine
+CC1CCCN(C2(c3ccccc3)CCCCC2)C1	C18H27N	arylcycloalkylamine
+C=CCN(C)C1(c2ccccc2)CCCCC1	C16H23N	arylcycloalkylamine
+C=CCN(CC=C)C1(c2ccccc2)CCCCC1	C18H25N	arylcycloalkylamine
+CNC1(c2ccccc2Br)CCCCC1=O	C13H16BrNO	arylcycloalkylamine
+CNC1(c2ccccc2C(F)(F)F)CCCCC1=O	C14H16F3NO	arylcycloalkylamine
+CN1CCN(C2(c3ccccc3)CCCCC2)CC1	C17H26N2	arylcycloalkylamine
+N#CC1(N2CCCCC2)CCCCC1	C12H20N2	unknown
+CCCCCn1c2ccccc2c2cc(C(=O)c3ccccc3)ccc21	C24H23NO	cannabinoid
+CN(CCO)Cc1csc(-c2cn(CC3CCOCC3)c3c(Cl)cccc23)n1	C21H26ClN3O2S	cannabinoid
+CCC(=O)N(c1ccccc1)C1CCN(Cc2ccccc2)CC1C	C22H28N2O	fentanyl
+COCC(=O)N(c1ccccc1)C1(C(=O)OC)CCN(CCc2cccs2)CC1	C22H28N2O4S	fentanyl
+CC(C)C(=O)C(c1ccc(F)cc1)C1CCN(Cc2ccccc2)CC1	C23H28FNO	fentanyl
+CNC(C(C)=O)c1ccccc1	C10H13NO	unknown
+CNC(C(C)=O)c1cccc(F)c1	C10H12FNO	unknown
+Cc1cccc(CN2CCNCC2)c1	C12H18N2	unknown
+CN1CCN(C(=O)OC2c3nccnc3C(=O)N2c2ccc(Cl)cn2)CC1	C17H17ClN6O3	unknown
+CCCN(CC)CCc1c[nH]c2cccc(OC(C)=O)c12	C17H24N2O2	tryptamine
+Cc1ccc(-c2nc3ccc(C)cn3c2CC(=O)N(C)C)cc1	C19H21N3O	unknown
+CCC(=O)N(c1cccc2cccnc12)C1CCN(CCc2ccccc2)CC1	C25H29N3O	fentanyl
+CCC(=O)N(C1CCN(CCc2ccccc2)CC1)C12CC3CC(CC(C3)C1)C2	C26H38N2O	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CCc2ccc3occc3c2)CC1	C24H28N2O2	fentanyl
+CC1CN(CCc2ccccc2)CCC1N(C(=O)c1ccco1)c1ccccc1	C25H28N2O2	fentanyl
+CC1CN(CCc2ccccc2)CC(C)C1N(C(=O)C1CCCC1)c1ccccc1	C27H36N2O	fentanyl
+CCCC(=O)N(c1ccccc1)C1(C(=O)OC)CCN(CCc2ccccc2)CC1	C25H32N2O3	fentanyl
+CCOC(=O)CCN1CCC(C(=O)OCC)(N(C(=O)CC)c2ccccc2)CC1	C22H32N2O5	fentanyl
+CCOC(=O)CCN1CCC(C(=O)OC)(N(C(=O)CC)c2ccc(F)cc2)CC1	C21H29FN2O5	fentanyl
+CCCC(=O)N(c1ccccc1)C1(C(=O)OC)CCN(CCC(=O)OC)CC1	C21H30N2O5	fentanyl
+COC(=O)CCN1CCC(C(=O)OC)(N(C(=O)c2ccco2)c2ccc(F)cc2)CC1	C22H25FN2O6	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(C(C)Cc2ccccc2)CC1C	C24H32N2O	fentanyl
+CCC(=O)N(c1ccccc1)C1(c2cccc(O)c2)CCN(CCc2ccccc2)CC1	C28H32N2O2	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CCc2ccccc2)CC1SC	C23H30N2OS	fentanyl
+CN1CCCC(OC(=O)C(O)(c2ccccc2)C2CCCCC2)C1	C20H29NO3	unknown
+O=C(OC1CN2CCC1CC2)C(O)(c1ccccc1)c1ccccc1	C21H23NO3	unknown
+CC1NCOC1c1ccccc1	C10H13NO	unknown
+CC1C(c2ccccc2)OCN1C	C11H15NO	unknown
+CCC(=O)N(c1ccccc1)C1CCN(CC(O)c2cccs2)CC1C	C21H28N2O2S	fentanyl
+CC(=O)Nc1ccccc1C(=O)O	C9H9NO3	unknown
+CCc1nc2ccccc2c(=O)n1-c1ccccc1	C16H14N2O	unknown
+O=C([O-])CCCO.[Na+]	C4H8O3.Na	unknown
+O=C(O)CCCO	C4H8O3	unknown
+OCCCCO	C4H10O2	unknown
+O=C1CCCO1	C4H6O2	unknown
+CNCCCc1ccc2c(c1)OCO2	C11H15NO2	unknown
+CCN(CC)CCOC(=O)C(O)(c1ccccc1)c1ccccc1	C20H25NO3	unknown
+CN1CCCC(OC(=O)C(O)(c2ccccc2)c2ccccc2)C1	C20H23NO3	unknown
+CCC(=O)N(c1ccccc1)C1(C(=O)OC2CN3CCC2CC3)CCN(CCc2c[nH]c3ccccc23)CC1	C32H40N4O3	fentanyl
+CN(C1=NC(=O)C(c2ccccc2)O1)C1CC1	C13H14N2O2	unknown
+N#CCCNCCc1ccccc1	C11H14N2	unknown
+COc1ccc(OC)c(OC)c1C=O	C10H12O4	unknown
+COc1cc(CCN(C)C(C)C)c(OC)cc1Br	C14H22BrNO2	unknown
+CCc1cc(OC)c(CCNO)cc1OC	C12H19NO3	unknown
+C=C(C)CN1C[C@H](C(=O)N(CC)CC)C=C2c3cccc4[nH]cc(c34)C[C@H]21	C23H29N3O	unknown
+CCc1nc(C)ccc1O	C8H11NO	unknown
+O=C(CS(=O)C(c1ccccc1)c1ccccc1)NO	C15H15NO3S	unknown
+NC(=O)CS(=O)C(c1ccc(F)cc1)c1ccc(F)cc1	C15H13F2NO2S	unknown
+CNC(=O)CS(=O)C(c1ccc(F)cc1)c1ccc(F)cc1	C16H15F2NO2S	unknown
+CCCNC(CCC)Cc1cc2ccccc2o1	C16H23NO	unknown
+COc1cc(OC)c(OC)cc1C=O	C10H12O4	unknown
+CCOc1cc(OC)c(C=O)cc1OC	C11H14O4	unknown
+COc1cc2c(cc1C=O)OCO2	C9H8O4	unknown
+COc1cc(OC)c(C=O)c(OC)c1	C10H12O4	unknown
+COc1cc(C=O)cc(OC)c1OC	C10H12O4	unknown
+COc1cc(C=O)cc2c1OCO2	C9H8O4	unknown
+COc1cc(C=O)c(OC)c2c1OCO2	C10H10O5	unknown
+COc1c(C=O)ccc2c1OCO2	C9H8O4	unknown
+COc1cc(C=O)ccc1O	C8H8O3	unknown
+C/C(=C\c1ccccc1)[N+](=O)[O-]	C9H9NO2	unknown
+COc1ccccc1/C=C(\C)[N+](=O)[O-]	C10H11NO3	unknown
+CCOc1ccccc1/C=C(\C)[N+](=O)[O-]	C11H13NO3	unknown
+COc1cccc(/C=C(\C)[N+](=O)[O-])c1	C10H11NO3	unknown
+CCOc1cccc(/C=C(\C)[N+](=O)[O-])c1	C11H13NO3	unknown
+COc1ccc(/C=C(\C)[N+](=O)[O-])cc1	C10H11NO3	unknown
+CCOc1ccc(/C=C(\C)[N+](=O)[O-])cc1	C11H13NO3	unknown
+CCCOc1ccc(/C=C(\C)[N+](=O)[O-])cc1	C12H15NO3	unknown
+COc1cccc(/C=C(\C)[N+](=O)[O-])c1OC	C11H13NO4	unknown
+C/C(=C\c1cccc2c1OCO2)[N+](=O)[O-]	C10H9NO4	unknown
+COc1ccc(/C=C(\C)[N+](=O)[O-])c(OC)c1	C11H13NO4	unknown
+CCOc1cc(OC)ccc1/C=C(\C)[N+](=O)[O-]	C12H15NO4	unknown
+COc1ccc(OC)c(/C=C(\C)[N+](=O)[O-])c1	C11H13NO4	unknown
+COc1cccc(OC)c1/C=C(\C)[N+](=O)[O-]	C11H13NO4	unknown
+COc1ccc(/C=C(\C)[N+](=O)[O-])cc1OC	C11H13NO4	unknown
+CCOc1ccc(/C=C(\C)[N+](=O)[O-])cc1OC	C12H15NO4	unknown
+CCOc1cc(/C=C(\C)[N+](=O)[O-])ccc1OC	C12H15NO4	unknown
+CCCOc1cc(/C=C(\C)[N+](=O)[O-])ccc1OC	C13H17NO4	unknown
+CCOc1ccc(/C=C(\C)[N+](=O)[O-])cc1OCC	C13H17NO4	unknown
+COc1cc(/C=C(\C)[N+](=O)[O-])cc(OC)c1	C11H13NO4	unknown
+COc1ccc(/C=C(\C)[N+](=O)[O-])c(OC)c1OC	C12H15NO5	unknown
+COc1cc(/C=C(\C)[N+](=O)[O-])c(OC)c(OC)c1	C12H15NO5	unknown
+COc1ccc(OC)c(OC)c1/C=C(\C)[N+](=O)[O-]	C12H15NO5	unknown
+COc1cc(OC)c(OC)cc1/C=C(\C)[N+](=O)[O-]	C12H15NO5	unknown
+CCOc1cc(OC)c(/C=C(\C)[N+](=O)[O-])cc1OC	C13H17NO5	unknown
+COc1cc2c(cc1/C=C(\C)[N+](=O)[O-])OCO2	C11H11NO5	unknown
+COc1cc(OC)c(/C=C(\C)[N+](=O)[O-])c(OC)c1	C12H15NO5	unknown
+COc1cc(/C=C(\C)[N+](=O)[O-])cc(OC)c1OC	C12H15NO5	unknown
+COc1cc(/C=C(\C)[N+](=O)[O-])cc2c1OCO2	C11H11NO5	unknown
+COc1cc(/C=C(\C)[N+](=O)[O-])c(OC)c2c1OCO2	C12H13NO6	unknown
+COc1c(/C=C(\C)[N+](=O)[O-])ccc2c1OCO2	C11H11NO5	unknown
+COc1c(/C=C(\C)[N+](=O)[O-])cc2c(c1OC)OCO2	C12H13NO6	unknown
+CCCOc1ccc(/C=C(\C)[N+](=O)[O-])cc1OC	C13H17NO4	unknown
+COc1cc(CC=O)c(OC)cc1Br	C10H11BrO3	unknown
+COc1cc(C=O)cc(OC)c1	C9H10O3	unknown
+COc1ccc(C=O)c(OC)c1OC	C10H12O4	unknown
+COc1cc(C=O)c(OC)c(OC)c1	C10H12O4	unknown
+COc1cc(CC=O)c(OC)cc1C	C11H14O3	unknown
+CCc1cc(OC)c(CC=O)cc1OC	C12H16O3	unknown
+COc1cc(CC=O)c(OC)cc1I	C10H11IO3	unknown
+CCSc1cc(OC)c(CC=O)cc1OC	C12H16O3S	unknown
+CCCSc1cc(OC)c(CC=O)cc1OC	C13H18O3S	unknown
+CCCCCSc1ccc(CC(C)N)cc1	C14H23NS	unknown
+CCCCCCSc1ccc(CC(C)N)cc1	C15H25NS	unknown
+COc1ccc(/C=C/[N+](=O)[O-])c(OC)c1OC	C11H13NO5	unknown
+COc1c(/C=C/[N+](=O)[O-])ccc(SC)c1OC	C11H13NO4S	unknown
+COc1ccc(/C=C/[N+](=O)[O-])c(OC)c1SC	C11H13NO4S	unknown
+COc1cc(/C=C/[N+](=O)[O-])c(OC)c(C)c1C	C12H15NO4	unknown
+C=CCSc1cc(OC)c(/C=C/[N+](=O)[O-])cc1OC	C13H15NO4S	unknown
+COc1cc(SC2CCC2)c(OC)cc1/C=C/[N+](=O)[O-]	C14H17NO4S	unknown
+COc1cc(SCC2CC2)c(OC)cc1/C=C/[N+](=O)[O-]	C14H17NO4S	unknown
+COc1cc(SC2CC2)c(OC)cc1/C=C/[N+](=O)[O-]	C13H15NO4S	unknown
+CCc1cc(OC)c(/C=C/[N+](=O)[O-])cc1OC	C12H15NO4	unknown
+CCSc1cc(OC)c(/C=C/[N+](=O)[O-])cc1OC	C12H15NO4S	unknown
+COc1cc(/C=C/[N+](=O)[O-])c(OC)cc1F	C10H10FNO4	unknown
+COc1cc(/C=C/[N+](=O)[O-])c(OC)cc1C	C11H13NO4	unknown
+COc1cc([Se]C)c(OC)cc1/C=C/[N+](=O)[O-]	C11H13NO4Se	unknown
+COc1ccc(OC)c(/C=C/[N+](=O)[O-])c1	C10H11NO4	unknown
+CCOc1cc(/C=C/[N+](=O)[O-])cc(OC)c1OCC	C13H17NO5	unknown
+COc1ccc(/C=C/[N+](=O)[O-])c(SC)c1OC	C11H13NO4S	unknown
+COc1ccc(/C=C/[N+](=O)[O-])cc1OC	C10H11NO4	unknown
+CCOc1c(OC)cc(/C=C/[N+](=O)[O-])cc1OC	C12H15NO5	unknown
+CCOc1cc(/C=C/[N+](=O)[O-])cc(SC)c1OC	C12H15NO4S	unknown
+CCOc1cc(/C=C/[N+](=O)[O-])ccc1OC	C11H13NO4	unknown
+CC(N)Cc1ccc(SC2CCCC2)cc1	C14H21NS	unknown
+CC(N)Cc1ccc(SC2CCCCC2)cc1	C15H23NS	unknown
+CCOc1cc(/C=C/[N+](=O)[O-])cc(SCC)c1OC	C13H17NO4S	unknown
+CCSc1cc(/C=C/[N+](=O)[O-])cc(OC)c1OC	C12H15NO4S	unknown
+COc1cc(/C=C/[N+](=O)[O-])cc2c1OCO2	C10H9NO5	unknown
+COc1cc(/C=C/[N+](=O)[O-])c(OC)cc1Br	C10H10BrNO4	unknown
+CCOc1c(OC)cc(/C=C/[N+](=O)[O-])cc1SCC	C13H17NO4S	unknown
+CCOc1ccc(/C=C/[N+](=O)[O-])cc1OC	C11H13NO4	unknown
+CCOc1c(OC)cc(/C=C/[N+](=O)[O-])cc1SC	C12H15NO4S	unknown
+CN(C)C(=O)c1nc(CNC(=O)CN)n(-c2ccc(Cl)cc2C(=O)c2ccccc2Cl)n1	C21H20Cl2N6O3	aryldiazepine
+CCCCSc1ccc(CC(C)N)cc1	C13H21NS	unknown
+CCCSc1ccc(CC(C)N)cc1	C12H19NS	unknown
+CN(C(=O)CNC(=O)[C@@H](N)CCCCN)c1ccc(Cl)cc1C(=O)c1ccccc1	C22H27ClN4O3	aryldiazepine
+CCOc1ccc(CC(N)CC)c(C)c1	C13H21NO	unknown
+CCCc1cc(CC(C)N)c(OC)cc1OC	C14H23NO2	unknown
+CCOc1ccc(CC(C)(C)N)c(C)c1	C13H21NO	unknown
+CCOc1ccc(CCC(C)N)c(C)c1	C13H21NO	unknown
+CCC(N)Cc1ccc(C(F)(F)F)cc1	C11H14F3N	unknown
+COc1ccc(OCC(C)N)cc1	C10H15NO2	unknown
+Cc1ccc(OCC(C)N)cc1	C10H15NO	unknown
+Cc1ccccc1OCC(C)N	C10H15NO	unknown
+CC(N)COc1ccc(C(F)(F)F)cc1	C10H12F3NO	unknown
+Cc1cc(Br)cc(C)c1OCC(C)N	C11H16BrNO	unknown
+Cc1ccc(OCC(C)N)c(Br)c1	C10H14BrNO	unknown
+Cc1cc(Br)ccc1OCC(C)N	C10H14BrNO	unknown
+CCNC(C)(C)Cc1ccc(OCC)cc1C	C15H25NO	unknown
+O=[N+]([O-])/C=C/c1ccccc1	C8H7NO2	unknown
+COc1cccc(/C=C/[N+](=O)[O-])c1	C9H9NO3	unknown
+COc1ccc(/C=C/[N+](=O)[O-])cc1	C9H9NO3	unknown
+COc1cc(/C=C/[N+](=O)[O-])cc(OC)c1	C10H11NO4	unknown
+O=Cc1ccccc1	C7H6O	unknown
+COc1ccccc1C=O	C8H8O2	unknown
+CCOc1ccccc1C=O	C9H10O2	unknown
+COc1cccc(C=O)c1	C8H8O2	unknown
+CCOc1cccc(C=O)c1	C9H10O2	unknown
+COc1ccc(C=O)cc1	C8H8O2	unknown
+CCOc1ccc(C=O)cc1	C9H10O2	unknown
+CCCOc1ccc(C=O)cc1	C10H12O2	unknown
+COc1cccc(C=O)c1OC	C9H10O3	unknown
+O=Cc1cccc2c1OCO2	C8H6O3	unknown
+COc1ccc(C=O)c(OC)c1	C9H10O3	unknown
+CCOc1cc(OC)ccc1C=O	C10H12O3	unknown
+COc1ccc(OC)c(C=O)c1	C9H10O3	unknown
+COc1cccc(OC)c1C=O	C9H10O3	unknown
+COc1ccc(C=O)cc1OC	C9H10O3	unknown
+CCOc1ccc(C=O)cc1OC	C10H12O3	unknown
+CCCOc1ccc(C=O)cc1OC	C11H14O3	unknown
+CCOc1cc(C=O)ccc1OC	C10H12O3	unknown
+CCCOc1cc(C=O)ccc1OC	C11H14O3	unknown
+CCOc1ccc(C=O)cc1OCC	C11H14O3	unknown
+CN(C)CCC(c1ccc(Cl)cc1)c1ccccn1	C16H19ClN2	unknown
+COc1ccc2c(c1)[C@]13CCCC[C@@H]1[C@H](C2)N(C)CC3	C18H25NO	unknown
+CN(C)C(=O)C(CCN1CCC(O)(c2ccc(Cl)cc2)CC1)(c1ccccc1)c1ccccc1	C29H33ClN2O2	unknown
+OC1CCN(CCc2ccccc2)CC1	C13H19NO	unknown
+CC(C)CC(C)N	C6H15N	unknown
+CCNC(C)C(=O)c1ccc2c(c1)OCCOCCOCCO2	C17H25NO5	beta-ketone
+NC(=O)CS(=O)(=O)C(c1ccccc1)c1ccccc1	C15H15NO3S	unknown
+CC(=O)N(C)C(C)C(=O)c1ccc(C)cc1	C13H17NO2	beta-ketone
+CCNC(C)C(=O)c1ccc(Br)cc1	C11H14BrNO	beta-ketone
+OCCOCCN1CCN(C2=Nc3ccccc3Sc3ccccc32)CC1	C21H25N3O2S	unknown
+Cc1ccccc1C(OCCN(C)C)c1ccccc1	C18H23NO	unknown
+CC(C(=O)c1ccc(F)cc1)N1CCCCC1	C14H18FNO	beta-ketone
+CCn1cc(C(=O)c2cccc3ccccc23)c2ccccc21	C21H17NO	cannabinoid
+CC(Cc1ccc2c(c1)OCCO2)N(C)O	C12H17NO3	unknown
+Cc1ccccc1-n1c(CF)nc2ccc(N)cc2c1=O	C16H14FN3O	unknown
+O=c1[nH]c2ccccc2n1CCN1CCN(c2cccc(C(F)(F)F)c2)CC1	C20H21F3N4O	unknown
+CN1CCCC1=O	C5H9NO	unknown
+CCN(Cc1ccncc1)C(=O)C(CO)c1ccccc1	C17H20N2O2	unknown
+CN1CCCCC(n2cc(C(=O)C34CC5CC(CC(C5)C3)C4)c3ccccc32)C1	C26H34N2O	cannabinoid
+NCC1(CC(=O)O)CCCCC1	C9H17NO2	unknown
+CCC(CC)(CNC(=O)CCCO)c1cccc(OC)c1	C17H27NO3	unknown
+Oc1ccc2c(c1)[C@@]13CCCC[C@@]1(O)[C@@H](C2)N(CC1CCC1)CC3	C21H29NO2	unknown
+C[C@](O)(COc1ccc(C#N)cc1)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1	C19H14F3N3O3	unknown
+CCc1c(C(=O)NCCc2ccc(N3CCCCC3)cc2)[nH]c2ccc(Cl)cc12	C24H28ClN3O	unknown
+CCc1c(C(=O)NCCc2ccc(N(C)C)cc2)[nH]c2ccc(F)cc12	C21H24FN3O	unknown
+CCc1c(C(=O)NC2CCN(Cc3ccccc3)C2)[nH]c2ccc(Cl)cc12	C22H24ClN3O	unknown
+CN1C2CCC1CC(OC(=O)c1ccc(F)cc1)C2	C15H18FNO2	unknown
+CCCCCn1cc(C(=O)c2ccc(CO)cc2)c2ccccc21	C21H23NO2	cannabinoid
+COC(=O)C1=CCCN(C)C1	C8H13NO2	unknown
+CC(C)N(C)CCc1c[nH]c2ccc(O)cc12	C14H20N2O	tryptamine
+CC(C)NCCc1c[nH]c2ccc(O)cc12	C13H18N2O	tryptamine
+COc1ccc2[nH]cc(CC[N+](C)([O-])C(C)C)c2c1	C15H22N2O2	tryptamine
+COc1ccc2[nH]cc(CC(=O)O)c2c1	C11H11NO3	unknown
+COc1ccc2[nH]cc(CC=O)c2c1	C11H11NO2	unknown
+O=[N+]([O-])c1ccc(O)c([N+](=O)[O-])c1	C6H4N2O5	unknown
+CCCCN(CCCC)C(=O)CN1CC(c2cc(OC)c3c(c2)OCO3)C(C(=O)O)C1CC(C)(C)CCC	C30H48N2O6	unknown
+COc1ccc(C2CNC(=O)C2)cc1OC1CCCC1	C16H21NO3	unknown
+c1cc(CN2CCNCC2)c2c(c1)OCO2	C12H16N2O2	unknown
+O=C(N1CCN(Cc2cccc3c2OCO3)CC1)C(F)(F)F	C14H15F3N2O3	unknown
+O=C(N1CCN(Cc2ccc3c(c2)OCO3)CC1)C(F)(F)F	C14H15F3N2O3	unknown
+O=C(N1CCN(Cc2cccc3c2OCO3)CC1)C(F)(F)C(F)(F)F	C15H15F5N2O3	unknown
+O=C(N1CCN(Cc2ccc3c(c2)OCO3)CC1)C(F)(F)C(F)(F)F	C15H15F5N2O3	unknown
+O=C(N1CCN(Cc2cccc3c2OCO3)CC1)C(F)(F)C(F)(F)C(F)(F)F	C16H15F7N2O3	unknown
+O=C(N1CCN(Cc2ccc3c(c2)OCO3)CC1)C(F)(F)C(F)(F)C(F)(F)F	C16H15F7N2O3	unknown
+CCOc1ccccc1CN1CCNCC1	C13H20N2O	unknown
+CCOc1cccc(CN2CCNCC2)c1	C13H20N2O	unknown
+CCOc1ccc(CN2CCNCC2)cc1	C13H20N2O	unknown
+CCOc1ccccc1CN1CCN(C(=O)C(F)(F)F)CC1	C15H19F3N2O2	unknown
+CCOc1cccc(CN2CCN(C(=O)C(F)(F)F)CC2)c1	C15H19F3N2O2	unknown
+CCOc1ccc(CN2CCN(C(=O)C(F)(F)F)CC2)cc1	C15H19F3N2O2	unknown
+COc1c(C)cccc1CN1CCNCC1	C13H20N2O	unknown
+COc1cccc(CN2CCNCC2)c1C	C13H20N2O	unknown
+COc1ccc(CN2CCNCC2)cc1C	C13H20N2O	unknown
+COc1cc(CN2CCNCC2)ccc1C	C13H20N2O	unknown
+COc1c(C)cccc1CN1CCN(C(=O)C(F)(F)C(F)(F)C(F)(F)F)CC1	C17H19F7N2O2	unknown
+COc1cccc(CN2CCN(C(=O)C(F)(F)C(F)(F)C(F)(F)F)CC2)c1C	C17H19F7N2O2	unknown
+COc1ccc(CN2CCN(C(=O)C(F)(F)C(F)(F)C(F)(F)F)CC2)cc1C	C17H19F7N2O2	unknown
+COc1cc(CN2CCN(C(=O)C(F)(F)C(F)(F)C(F)(F)F)CC2)ccc1C	C17H19F7N2O2	unknown
+COc1cc(C)ccc1CN1CCNCC1	C13H20N2O	unknown
+COc1ccc(C)cc1CN1CCNCC1	C13H20N2O	unknown
+COc1cccc(C)c1CN1CCNCC1	C13H20N2O	unknown
+COc1cc(C)cc(CN2CCNCC2)c1	C13H20N2O	unknown
+COc1ccc(C)c(CN2CCNCC2)c1	C13H20N2O	unknown
+COc1ccc(CN2CCNCC2)c(C)c1	C13H20N2O	unknown
+COc1c(C)cccc1CN1CCN(C(=O)C(F)(F)C(F)(F)F)CC1	C16H19F5N2O2	unknown
+COc1cc(C)ccc1CN1CCN(C(=O)C(F)(F)C(F)(F)F)CC1	C16H19F5N2O2	unknown
+COc1ccc(C)cc1CN1CCN(C(=O)C(F)(F)C(F)(F)F)CC1	C16H19F5N2O2	unknown
+COc1cccc(C)c1CN1CCN(C(=O)C(F)(F)C(F)(F)F)CC1	C16H19F5N2O2	unknown
+COc1cccc(CN2CCN(C(=O)C(F)(F)C(F)(F)F)CC2)c1C	C16H19F5N2O2	unknown
+COc1cc(CN2CCN(C(=O)C(F)(F)C(F)(F)F)CC2)ccc1C	C16H19F5N2O2	unknown
+COc1cc(C)cc(CN2CCN(C(=O)C(F)(F)C(F)(F)F)CC2)c1	C16H19F5N2O2	unknown
+COc1ccc(C)c(CN2CCN(C(=O)C(F)(F)C(F)(F)F)CC2)c1	C16H19F5N2O2	unknown
+COc1ccc(CN2CCN(C(=O)C(F)(F)C(F)(F)F)CC2)cc1C	C16H19F5N2O2	unknown
+COc1ccc(CN2CCN(C(=O)C(F)(F)C(F)(F)F)CC2)c(C)c1	C16H19F5N2O2	unknown
+COc1cccc(CN2CCN(C(=O)C(F)(F)C(F)(F)C(F)(F)F)CC2)c1OC	C17H19F7N2O3	unknown
+COc1ccc(CN2CCN(C(=O)C(F)(F)C(F)(F)C(F)(F)F)CC2)c(OC)c1	C17H19F7N2O3	unknown
+COc1ccc(OC)c(CN2CCN(C(=O)C(F)(F)C(F)(F)C(F)(F)F)CC2)c1	C17H19F7N2O3	unknown
+COc1cccc(OC)c1CN1CCN(C(=O)C(F)(F)C(F)(F)C(F)(F)F)CC1	C17H19F7N2O3	unknown
+COc1ccc(CN2CCN(C(=O)C(F)(F)C(F)(F)C(F)(F)F)CC2)cc1OC	C17H19F7N2O3	unknown
+COc1cc(CN2CCN(C(=O)C(F)(F)C(F)(F)C(F)(F)F)CC2)cc(OC)c1	C17H19F7N2O3	unknown
+COc1cccc(CN2CCN(C)CC2)c1OC	C14H22N2O2	unknown
+COc1ccc(CN2CCN(C)CC2)c(OC)c1	C14H22N2O2	unknown
+COc1ccc(OC)c(CN2CCN(C)CC2)c1	C14H22N2O2	unknown
+COc1cccc(OC)c1CN1CCN(C)CC1	C14H22N2O2	unknown
+COc1ccc(CN2CCN(C)CC2)cc1OC	C14H22N2O2	unknown
+COc1cc(CN2CCN(C)CC2)cc(OC)c1	C14H22N2O2	unknown
+COc1ccc(Br)c(CN2CCNCC2)c1OC	C13H19BrN2O2	unknown
+COc1cc(Br)cc(CN2CCNCC2)c1OC	C13H19BrN2O2	unknown
+COc1cc(Br)c(CN2CCNCC2)cc1OC	C13H19BrN2O2	unknown
+COc1cc(OC)c(CN2CCNCC2)cc1Br	C13H19BrN2O2	unknown
+COc1cc(CN2CCNCC2)cc(OC)c1Br	C13H19BrN2O2	unknown
+COc1cc(Br)cc(OC)c1CN1CCNCC1	C13H19BrN2O2	unknown
+COc1ccc(Br)c(CN2CCN(C(=O)C(F)(F)C(F)(F)F)CC2)c1OC	C16H18BrF5N2O3	unknown
+COc1cc(Br)cc(CN2CCN(C(=O)C(F)(F)C(F)(F)F)CC2)c1OC	C16H18BrF5N2O3	unknown
+COc1cc(Br)c(CN2CCN(C(=O)C(F)(F)C(F)(F)F)CC2)cc1OC	C16H18BrF5N2O3	unknown
+COc1cc(OC)c(CN2CCN(C(=O)C(F)(F)C(F)(F)F)CC2)cc1Br	C16H18BrF5N2O3	unknown
+COc1cc(CN2CCN(C(=O)C(F)(F)C(F)(F)F)CC2)cc(OC)c1Br	C16H18BrF5N2O3	unknown
+COc1cc(Br)cc(OC)c1CN1CCN(C(=O)C(F)(F)C(F)(F)F)CC1	C16H18BrF5N2O3	unknown
+COc1cc(CN2CCN(C(=O)C(F)(F)C(F)(F)F)CC2)c(OC)cc1Br	C16H18BrF5N2O3	unknown
+Fc1ccccc1CN1CCNCC1	C11H15FN2	unknown
+Fc1cccc(CN2CCNCC2)c1	C11H15FN2	unknown
+Fc1ccc(CN2CCNCC2)cc1	C11H15FN2	unknown
+O=C(N1CCN(Cc2ccccc2F)CC1)C(F)(F)C(F)(F)C(F)(F)F	C15H14F8N2O	unknown
+O=C(N1CCN(Cc2cccc(F)c2)CC1)C(F)(F)C(F)(F)C(F)(F)F	C15H14F8N2O	unknown
+O=C(N1CCN(Cc2ccc(F)cc2)CC1)C(F)(F)C(F)(F)C(F)(F)F	C15H14F8N2O	unknown
+Clc1ccccc1CN1CCNCC1	C11H15ClN2	unknown
+Clc1cccc(CN2CCNCC2)c1	C11H15ClN2	unknown
+O=C(N1CCN(Cc2ccccc2Cl)CC1)C(F)(F)C(F)(F)F	C14H14ClF5N2O	unknown
+O=C(N1CCN(Cc2cccc(Cl)c2)CC1)C(F)(F)C(F)(F)F	C14H14ClF5N2O	unknown
+O=C(N1CCN(Cc2ccc(Cl)cc2)CC1)C(F)(F)C(F)(F)F	C14H14ClF5N2O	unknown
+Brc1ccccc1CN1CCNCC1	C11H15BrN2	unknown
+Brc1cccc(CN2CCNCC2)c1	C11H15BrN2	unknown
+Brc1ccc(CN2CCNCC2)cc1	C11H15BrN2	unknown
+O=C(N1CCN(Cc2ccccc2Br)CC1)C(F)(F)C(F)(F)C(F)(F)F	C15H14BrF7N2O	unknown
+O=C(N1CCN(Cc2cccc(Br)c2)CC1)C(F)(F)C(F)(F)C(F)(F)F	C15H14BrF7N2O	unknown
+O=C(N1CCN(Cc2ccc(Br)cc2)CC1)C(F)(F)C(F)(F)C(F)(F)F	C15H14BrF7N2O	unknown
+COc1ccccc1CN1CCN(C(=O)C(F)(F)F)CC1	C14H17F3N2O2	unknown
+COc1cccc(CN2CCN(C(=O)C(F)(F)F)CC2)c1	C14H17F3N2O2	unknown
+COc1ccc(CN2CCN(C(=O)C(F)(F)F)CC2)cc1	C14H17F3N2O2	unknown
+O=C(c1ccccc1)N1CCNCC1	C11H14N2O	unknown
+CN1CCN(C(=O)c2ccccc2)CC1	C12H16N2O	unknown
+Cc1ccccc1CN1CCN(C(=O)C(F)(F)C(F)(F)C(F)(F)F)CC1	C16H17F7N2O	unknown
+Cc1cccc(CN2CCN(C(=O)C(F)(F)C(F)(F)C(F)(F)F)CC2)c1	C16H17F7N2O	unknown
+Cc1ccc(CN2CCN(C(=O)C(F)(F)C(F)(F)C(F)(F)F)CC2)cc1	C16H17F7N2O	unknown
+O=C(c1ccccc1)N1CCN(C(=O)C(F)(F)C(F)(F)C(F)(F)F)CC1	C15H13F7N2O2	unknown
+COc1ccccc1C(=O)N1CCNCC1	C12H16N2O2	unknown
+COc1cccc(C(=O)N2CCNCC2)c1	C12H16N2O2	unknown
+COc1ccc(C(=O)N2CCNCC2)cc1	C12H16N2O2	unknown
+COc1ccccc1C(=O)N1CCN(C(=O)C(F)(F)C(F)(F)C(F)(F)F)CC1	C16H15F7N2O3	unknown
+COc1cccc(C(=O)N2CCN(C(=O)C(F)(F)C(F)(F)C(F)(F)F)CC2)c1	C16H15F7N2O3	unknown
+COc1ccc(C(=O)N2CCN(C(=O)C(F)(F)C(F)(F)C(F)(F)F)CC2)cc1	C16H15F7N2O3	unknown
+FC(F)(F)c1ccccc1CN1CCNCC1	C12H15F3N2	unknown
+FC(F)(F)c1cccc(CN2CCNCC2)c1	C12H15F3N2	unknown
+FC(F)(F)c1ccc(CN2CCNCC2)cc1	C12H15F3N2	unknown
+O=C(N1CCN(Cc2ccccc2C(F)(F)F)CC1)C(F)(F)C(F)(F)C(F)(F)F	C16H14F10N2O	unknown
+O=C(c1cccc(C(F)(F)F)c1)N1CCN(C(=O)C(F)(F)C(F)(F)C(F)(F)F)CC1	C16H12F10N2O2	unknown
+O=C(c1ccc(C(F)(F)F)cc1)N1CCN(C(=O)C(F)(F)C(F)(F)C(F)(F)F)CC1	C16H12F10N2O2	unknown
+O=C(c1ccccc1C(F)(F)F)N1CCNCC1	C12H13F3N2O	unknown
+O=C(c1cccc(C(F)(F)F)c1)N1CCNCC1	C12H13F3N2O	unknown
+O=C(c1ccc(C(F)(F)F)cc1)N1CCNCC1	C12H13F3N2O	unknown
+O=C(c1ccccc1C(F)(F)F)N1CCN(C(=O)C(F)(F)C(F)(F)F)CC1	C15H12F8N2O2	unknown
+O=C(c1cccc(C(F)(F)F)c1)N1CCN(C(=O)C(F)(F)C(F)(F)F)CC1	C15H12F8N2O2	unknown
+O=C(c1ccc(C(F)(F)F)cc1)N1CCN(C(=O)C(F)(F)C(F)(F)F)CC1	C15H12F8N2O2	unknown
+COc1cccc(C(=O)N2CCNCC2)c1OC	C13H18N2O3	unknown
+COc1ccc(C(=O)N2CCNCC2)c(OC)c1	C13H18N2O3	unknown
+COc1cccc(OC)c1C(=O)N1CCNCC1	C13H18N2O3	unknown
+COc1ccc(C(=O)N2CCNCC2)cc1OC	C13H18N2O3	unknown
+COc1cc(OC)cc(C(=O)N2CCNCC2)c1	C13H18N2O3	unknown
+COc1cccc(C(=O)N2CCN(C(=O)C(F)(F)F)CC2)c1OC	C15H17F3N2O4	unknown
+COc1ccc(C(=O)N2CCN(C(=O)C(F)(F)F)CC2)c(OC)c1	C15H17F3N2O4	unknown
+COc1ccc(OC)c(C(=O)N2CCN(C(=O)C(F)(F)F)CC2)c1	C15H17F3N2O4	unknown
+COc1cccc(OC)c1C(=O)N1CCN(C(=O)C(F)(F)F)CC1	C15H17F3N2O4	unknown
+COc1ccc(C(=O)N2CCN(C(=O)C(F)(F)F)CC2)cc1OC	C15H17F3N2O4	unknown
+COc1cc(OC)cc(C(=O)N2CCN(C(=O)C(F)(F)F)CC2)c1	C15H17F3N2O4	unknown
+COc1cccc(C(=O)N2CCN(C)CC2)c1OC	C14H20N2O3	unknown
+COc1ccc(C(=O)N2CCN(C)CC2)c(OC)c1	C14H20N2O3	unknown
+COc1ccc(OC)c(C(=O)N2CCN(C)CC2)c1	C14H20N2O3	unknown
+COc1cccc(OC)c1C(=O)N1CCN(C)CC1	C14H20N2O3	unknown
+COc1ccc(C(=O)N2CCN(C)CC2)cc1OC	C14H20N2O3	unknown
+COc1cc(OC)cc(C(=O)N2CCN(C)CC2)c1	C14H20N2O3	unknown
+Cc1ccccc1C(=O)N1CCNCC1	C12H16N2O	unknown
+Cc1cccc(C(=O)N2CCNCC2)c1	C12H16N2O	unknown
+Cc1ccc(C(=O)N2CCNCC2)cc1	C12H16N2O	unknown
+Cc1ccccc1C(=O)N1CCN(C(=O)C(F)(F)C(F)(F)F)CC1	C15H15F5N2O2	unknown
+Cc1cccc(C(=O)N2CCN(C(=O)C(F)(F)C(F)(F)F)CC2)c1	C15H15F5N2O2	unknown
+Cc1ccc(C(=O)N2CCN(C(=O)C(F)(F)C(F)(F)F)CC2)cc1	C15H15F5N2O2	unknown
+O=C(N1CCN(c2ccccc2Cl)CC1)C(F)(F)C(F)(F)C(F)(F)F	C14H12ClF7N2O	unknown
+O=C(N1CCN(c2cccc(Cl)c2)CC1)C(F)(F)C(F)(F)C(F)(F)F	C14H12ClF7N2O	unknown
+O=C(N1CCN(c2ccc(Cl)cc2)CC1)C(F)(F)C(F)(F)C(F)(F)F	C14H12ClF7N2O	unknown
+Cc1ccccc1N1CCNCC1	C11H16N2	unknown
+Cc1cccc(N2CCNCC2)c1	C11H16N2	unknown
+Cc1ccc(N2CCNCC2)cc1	C11H16N2	unknown
+Cc1ccccc1N1CCN(C(=O)C(F)(F)C(F)(F)C(F)(F)F)CC1	C15H15F7N2O	unknown
+Cc1cccc(N2CCN(C(=O)C(F)(F)C(F)(F)C(F)(F)F)CC2)c1	C15H15F7N2O	unknown
+Cc1ccc(N2CCN(C(=O)C(F)(F)C(F)(F)C(F)(F)F)CC2)cc1	C15H15F7N2O	unknown
+COc1ccccc1N1CCN(C(=O)C(F)(F)C(F)(F)C(F)(F)F)CC1	C15H15F7N2O2	unknown
+COc1cccc(N2CCN(C(=O)C(F)(F)C(F)(F)C(F)(F)F)CC2)c1	C15H15F7N2O2	unknown
+COc1ccc(N2CCN(C(=O)C(F)(F)C(F)(F)C(F)(F)F)CC2)cc1	C15H15F7N2O2	unknown
+Cc1cccc(N2CCNCC2)c1C	C12H18N2	unknown
+Cc1ccc(N2CCNCC2)c(C)c1	C12H18N2	unknown
+Cc1ccc(C)c(N2CCNCC2)c1	C12H18N2	unknown
+Cc1cccc(C)c1N1CCNCC1	C12H18N2	unknown
+Cc1ccc(N2CCNCC2)cc1C	C12H18N2	unknown
+Cc1cc(C)cc(N2CCNCC2)c1	C12H18N2	unknown
+Cc1cccc(N2CCN(C(=O)C(F)(F)C(F)(F)C(F)(F)F)CC2)c1C	C16H17F7N2O	unknown
+Cc1ccc(N2CCN(C(=O)C(F)(F)C(F)(F)C(F)(F)F)CC2)c(C)c1	C16H17F7N2O	unknown
+Cc1ccc(C)c(N2CCN(C(=O)C(F)(F)C(F)(F)C(F)(F)F)CC2)c1	C16H17F7N2O	unknown
+Cc1cccc(C)c1N1CCN(C(=O)C(F)(F)C(F)(F)C(F)(F)F)CC1	C16H17F7N2O	unknown
+Cc1ccc(N2CCN(C(=O)C(F)(F)C(F)(F)C(F)(F)F)CC2)cc1C	C16H17F7N2O	unknown
+Cc1cc(C)cc(N2CCN(C(=O)C(F)(F)C(F)(F)C(F)(F)F)CC2)c1	C16H17F7N2O	unknown
+COc1cccc(N2CCNCC2)c1OC	C12H18N2O2	unknown
+COc1ccc(N2CCNCC2)c(OC)c1	C12H18N2O2	unknown
+COc1cccc(OC)c1N1CCNCC1	C12H18N2O2	unknown
+COc1ccc(N2CCNCC2)cc1OC	C12H18N2O2	unknown
+COc1cc(OC)cc(N2CCNCC2)c1	C12H18N2O2	unknown
+COc1cccc(N2CCN(C(=O)C(F)(F)C(F)(F)C(F)(F)F)CC2)c1OC	C16H17F7N2O3	unknown
+COc1ccc(N2CCN(C(=O)C(F)(F)C(F)(F)C(F)(F)F)CC2)c(OC)c1	C16H17F7N2O3	unknown
+COc1ccc(OC)c(N2CCN(C(=O)C(F)(F)C(F)(F)C(F)(F)F)CC2)c1	C16H17F7N2O3	unknown
+COc1cccc(OC)c1N1CCN(C(=O)C(F)(F)C(F)(F)C(F)(F)F)CC1	C16H17F7N2O3	unknown
+COc1ccc(N2CCN(C(=O)C(F)(F)C(F)(F)C(F)(F)F)CC2)cc1OC	C16H17F7N2O3	unknown
+COc1cc(OC)cc(N2CCN(C(=O)C(F)(F)C(F)(F)C(F)(F)F)CC2)c1	C16H17F7N2O3	unknown
+COc1ccccc1C(=O)C(C)N1CCNCC1	C14H20N2O2	beta-ketone
+COc1cccc(C(=O)C(C)N2CCNCC2)c1	C14H20N2O2	beta-ketone
+COc1ccc(C(=O)C(C)N2CCNCC2)cc1	C14H20N2O2	beta-ketone
+CC(Cc1cccc2c1OCO2)N1CCNCC1	C14H20N2O2	unknown
+CC(Cc1ccc2c(c1)OCO2)N1CCNCC1	C14H20N2O2	unknown
+COc1ccccc1C(=O)C(C)N1CCN(C(=O)C(F)(F)C(F)(F)C(F)(F)F)CC1	C18H19F7N2O3	beta-ketone
+COc1cccc(C(=O)C(C)N2CCN(C(=O)C(F)(F)C(F)(F)C(F)(F)F)CC2)c1	C18H19F7N2O3	beta-ketone
+COc1ccc(C(=O)C(C)N2CCN(C(=O)C(F)(F)C(F)(F)C(F)(F)F)CC2)cc1	C18H19F7N2O3	beta-ketone
+CC(Cc1cccc2c1OCO2)N1CCN(C(=O)C(F)(F)C(F)(F)C(F)(F)F)CC1	C18H19F7N2O3	unknown
+CC(Cc1ccc2c(c1)OCO2)N1CCN(C(=O)C(F)(F)C(F)(F)C(F)(F)F)CC1	C18H19F7N2O3	unknown
+CC(Cc1ccccc1)N1CCNCC1	C13H20N2	unknown
+CC(Cc1ccccc1)N1CCN(C(=O)C(F)(F)C(F)(F)C(F)(F)F)CC1	C17H19F7N2O	unknown
+COc1ccccc1CC(C)N1CCNCC1	C14H22N2O	unknown
+COc1cccc(CC(C)N2CCNCC2)c1	C14H22N2O	unknown
+COc1ccc(CC(C)N2CCNCC2)cc1	C14H22N2O	unknown
+COc1ccccc1CC(C)N1CCN(C(=O)C(F)(F)C(F)(F)C(F)(F)F)CC1	C18H21F7N2O2	unknown
+COc1cccc(CC(C)N2CCN(C(=O)C(F)(F)C(F)(F)C(F)(F)F)CC2)c1	C18H21F7N2O2	unknown
+COc1ccc(CC(C)N2CCN(C(=O)C(F)(F)C(F)(F)C(F)(F)F)CC2)cc1	C18H21F7N2O2	unknown
+CC(C(=O)c1ccccc1F)N1CCNCC1	C13H17FN2O	beta-ketone
+CC(C(=O)c1cccc(F)c1)N1CCNCC1	C13H17FN2O	beta-ketone
+CC(C(=O)c1ccc(F)cc1)N1CCNCC1	C13H17FN2O	beta-ketone
+CC(C(=O)c1ccccc1F)N1CCN(C(=O)C(F)(F)C(F)(F)F)CC1	C16H16F6N2O2	beta-ketone
+CC(C(=O)c1cccc(F)c1)N1CCN(C(=O)C(F)(F)C(F)(F)F)CC1	C16H16F6N2O2	beta-ketone
+CC(C(=O)c1ccc(F)cc1)N1CCN(C(=O)C(F)(F)C(F)(F)F)CC1	C16H16F6N2O2	beta-ketone
+CC(C(=O)c1ccccc1Cl)N1CCNCC1	C13H17ClN2O	beta-ketone
+CC(C(=O)c1cccc(Cl)c1)N1CCNCC1	C13H17ClN2O	beta-ketone
+CC(C(=O)c1ccc(Cl)cc1)N1CCNCC1	C13H17ClN2O	beta-ketone
+CC(C(=O)c1ccccc1Cl)N1CCN(C(=O)C(F)(F)C(F)(F)F)CC1	C16H16ClF5N2O2	beta-ketone
+CC(C(=O)c1cccc(Cl)c1)N1CCN(C(=O)C(F)(F)C(F)(F)F)CC1	C16H16ClF5N2O2	beta-ketone
+CC(C(=O)c1ccc(Cl)cc1)N1CCN(C(=O)C(F)(F)C(F)(F)F)CC1	C16H16ClF5N2O2	beta-ketone
+CC(C(=O)c1ccccc1Br)N1CCNCC1	C13H17BrN2O	beta-ketone
+CC(C(=O)c1cccc(Br)c1)N1CCNCC1	C13H17BrN2O	beta-ketone
+CC(C(=O)c1ccc(Br)cc1)N1CCNCC1	C13H17BrN2O	beta-ketone
+CC(C(=O)c1ccccc1Br)N1CCN(C(=O)C(F)(F)C(F)(F)F)CC1	C16H16BrF5N2O2	beta-ketone
+CC(C(=O)c1cccc(Br)c1)N1CCN(C(=O)C(F)(F)C(F)(F)F)CC1	C16H16BrF5N2O2	beta-ketone
+CC(C(=O)c1ccc(Br)cc1)N1CCN(C(=O)C(F)(F)C(F)(F)F)CC1	C16H16BrF5N2O2	beta-ketone
+CC(C(=O)c1ccccc1C(F)(F)F)N1CCNCC1	C14H17F3N2O	beta-ketone
+CC(C(=O)c1cccc(C(F)(F)F)c1)N1CCNCC1	C14H17F3N2O	beta-ketone
+CC(C(=O)c1ccc(C(F)(F)F)cc1)N1CCNCC1	C14H17F3N2O	beta-ketone
+CC(C(=O)c1ccccc1C(F)(F)F)N1CCN(C(=O)C(F)(F)C(F)(F)F)CC1	C17H16F8N2O2	beta-ketone
+CC(C(=O)c1cccc(C(F)(F)F)c1)N1CCN(C(=O)C(F)(F)C(F)(F)F)CC1	C17H16F8N2O2	beta-ketone
+CC(C(=O)c1ccc(C(F)(F)F)cc1)N1CCN(C(=O)C(F)(F)C(F)(F)F)CC1	C17H16F8N2O2	beta-ketone
+CN(C(=O)Cc1cccc2occc12)[C@H]1CC[C@@]2(CCCO2)C[C@@H]1N1CCCC1	C24H32N2O3	unknown
+COC(=O)[C@@H]1C[C@H](OC(C)=O)C(=O)[C@H]2[C@@]1(C)CC[C@H]1C(=O)O[C@H](c3ccoc3)C[C@]21C	C23H28O8	unknown
+COCO[C@H]1C[C@@H](C(=O)OC)[C@]2(C)CC[C@H]3C(=O)O[C@H](c4ccoc4)C[C@]3(C)[C@H]2C1=O	C23H30O8	unknown
+CCN(C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1)C1CC1	C21H25N3O	unknown
+Cc1ccccc1C1OCCNC1C	C12H17NO	unknown
+CC1NCCOC1c1ccccc1F	C11H14FNO	unknown
+CC1NCCOC1c1ccc(F)cc1	C11H14FNO	unknown
+Cc1ccccc1C1OCCN(C(=O)C(F)(F)F)C1C	C14H16F3NO2	unknown
+Cc1cccc(C2OCCN(C(=O)C(F)(F)F)C2C)c1	C14H16F3NO2	unknown
+Cc1ccc(C2OCCN(C(=O)C(F)(F)F)C2C)cc1	C14H16F3NO2	unknown
+CCN(CCc1ccc2c(c1)OCO2)C(=O)C(F)(F)C(F)(F)F	C14H14F5NO3	unknown
+CC(Cc1ccc2c(c1)OCO2)N(C)C(=O)C(F)(F)C(F)(F)F	C14H14F5NO3	unknown
+CC(C)(Cc1ccc2c(c1)OCO2)NC(=O)C(F)(F)C(F)(F)F	C14H14F5NO3	unknown
+CCC(Cc1ccc2c(c1)OCO2)NC(=O)C(F)(F)C(F)(F)F	C14H14F5NO3	unknown
+CCN(CCc1cccc2c1OCO2)C(=O)C(F)(F)C(F)(F)F	C14H14F5NO3	unknown
+CC(Cc1cccc2c1OCO2)N(C)C(=O)C(F)(F)C(F)(F)F	C14H14F5NO3	unknown
+CC(C)(Cc1cccc2c1OCO2)NC(=O)C(F)(F)C(F)(F)F	C14H14F5NO3	unknown
+CCC(Cc1cccc2c1OCO2)NC(=O)C(F)(F)C(F)(F)F	C14H14F5NO3	unknown
+CCN(CCc1ccc2c(c1)OCO2)C(=O)C(F)(F)C(F)(F)C(F)(F)F	C15H14F7NO3	unknown
+CC(Cc1ccc2c(c1)OCO2)N(C)C(=O)C(F)(F)C(F)(F)C(F)(F)F	C15H14F7NO3	unknown
+CC(C)(Cc1ccc2c(c1)OCO2)NC(=O)C(F)(F)C(F)(F)C(F)(F)F	C15H14F7NO3	unknown
+CCC(Cc1ccc2c(c1)OCO2)NC(=O)C(F)(F)C(F)(F)C(F)(F)F	C15H14F7NO3	unknown
+CCN(CCc1cccc2c1OCO2)C(=O)C(F)(F)C(F)(F)C(F)(F)F	C15H14F7NO3	unknown
+CC(Cc1cccc2c1OCO2)N(C)C(=O)C(F)(F)C(F)(F)C(F)(F)F	C15H14F7NO3	unknown
+CC(C)(Cc1cccc2c1OCO2)NC(=O)C(F)(F)C(F)(F)C(F)(F)F	C15H14F7NO3	unknown
+CCC(Cc1cccc2c1OCO2)NC(=O)C(F)(F)C(F)(F)C(F)(F)F	C15H14F7NO3	unknown
+COc1ccccc1C(=O)C(C)N(C)C(=O)C(F)(F)C(F)(F)F	C14H14F5NO3	beta-ketone
+COc1cccc(C(=O)C(C)N(C)C(=O)C(F)(F)C(F)(F)F)c1	C14H14F5NO3	beta-ketone
+COc1ccc(C(=O)C(C)N(C)C(=O)C(F)(F)C(F)(F)F)cc1	C14H14F5NO3	beta-ketone
+COc1ccccc1C(=O)C(C)N(C)C(=O)C(F)(F)C(F)(F)C(F)(F)F	C15H14F7NO3	beta-ketone
+COc1cccc(C(=O)C(C)N(C)C(=O)C(F)(F)C(F)(F)C(F)(F)F)c1	C15H14F7NO3	beta-ketone
+COc1ccc(C(=O)C(C)N(C)C(=O)C(F)(F)C(F)(F)C(F)(F)F)cc1	C15H14F7NO3	beta-ketone
+COc1cc(C)ccc1CCN(C)C	C12H19NO	unknown
+CCNCCc1ccc(C)cc1OC	C12H19NO	unknown
+COc1cc(C)ccc1CC(C)(C)N	C12H19NO	unknown
+CCC(N)Cc1ccc(C)cc1OC	C12H19NO	unknown
+CCN(CCc1ccc(C)cc1OC)C(=O)C(F)(F)C(F)(F)F	C15H18F5NO2	unknown
+COc1cc(C)ccc1CC(C)N(C)C(=O)C(F)(F)C(F)(F)F	C15H18F5NO2	unknown
+COc1cc(C)ccc1CC(C)(C)NC(=O)C(F)(F)C(F)(F)F	C15H18F5NO2	unknown
+CCC(Cc1ccc(C)cc1OC)NC(=O)C(F)(F)C(F)(F)F	C15H18F5NO2	unknown
+CCN(CCc1ccc(C)cc1OC)C(=O)C(F)(F)C(F)(F)C(F)(F)F	C16H18F7NO2	unknown
+COc1cc(C)ccc1CC(C)N(C)C(=O)C(F)(F)C(F)(F)C(F)(F)F	C16H18F7NO2	unknown
+COc1cc(C)ccc1CC(C)(C)NC(=O)C(F)(F)C(F)(F)C(F)(F)F	C16H18F7NO2	unknown
+CCC(Cc1ccc(C)cc1OC)NC(=O)C(F)(F)C(F)(F)C(F)(F)F	C16H18F7NO2	unknown
+CCNCCc1ccc(OC)c(C)c1	C12H19NO	unknown
+NC1Cc2cc3ccoc3cc2C1	C11H11NO	unknown
+CCN(CCc1ccc(OC)c(C)c1)C(=O)C(F)(F)C(F)(F)F	C15H18F5NO2	unknown
+COc1ccc(CC(C)N(C)C(=O)C(F)(F)C(F)(F)F)cc1C	C15H18F5NO2	unknown
+COc1ccc(CC(C)(C)NC(=O)C(F)(F)C(F)(F)F)cc1C	C15H18F5NO2	unknown
+CCC(Cc1ccc(OC)c(C)c1)NC(=O)C(F)(F)C(F)(F)F	C15H18F5NO2	unknown
+CCN(CCc1ccc(OC)c(C)c1)C(=O)C(F)(F)C(F)(F)C(F)(F)F	C16H18F7NO2	unknown
+COc1ccc(CC(C)N(C)C(=O)C(F)(F)C(F)(F)C(F)(F)F)cc1C	C16H18F7NO2	unknown
+COc1ccc(CC(C)(C)NC(=O)C(F)(F)C(F)(F)C(F)(F)F)cc1C	C16H18F7NO2	unknown
+CCC(Cc1ccc(OC)c(C)c1)NC(=O)C(F)(F)C(F)(F)C(F)(F)F	C16H18F7NO2	unknown
+CCNCCc1ccc(C)c(OC)c1	C12H19NO	unknown
+COc1cc(CC(C)(C)N)ccc1C	C12H19NO	unknown
+CCC(N)Cc1ccc(C)c(OC)c1	C12H19NO	unknown
+CCN(CCc1ccc(C)c(OC)c1)C(=O)C(F)(F)C(F)(F)F	C15H18F5NO2	unknown
+COc1cc(CC(C)N(C)C(=O)C(F)(F)C(F)(F)F)ccc1C	C15H18F5NO2	unknown
+COc1cc(CC(C)(C)NC(=O)C(F)(F)C(F)(F)F)ccc1C	C15H18F5NO2	unknown
+CCC(Cc1ccc(C)c(OC)c1)NC(=O)C(F)(F)C(F)(F)F	C15H18F5NO2	unknown
+CCN(CCc1ccc(C)c(OC)c1)C(=O)C(F)(F)C(F)(F)C(F)(F)F	C16H18F7NO2	unknown
+COc1cc(CC(C)N(C)C(=O)C(F)(F)C(F)(F)C(F)(F)F)ccc1C	C16H18F7NO2	unknown
+COc1cc(CC(C)(C)NC(=O)C(F)(F)C(F)(F)C(F)(F)F)ccc1C	C16H18F7NO2	unknown
+CCC(Cc1ccc(C)c(OC)c1)NC(=O)C(F)(F)C(F)(F)C(F)(F)F	C16H18F7NO2	unknown
+CNC(C)Cc1cc(C)ccc1OC	C12H19NO	unknown
+CNC(C)Cc1c(C)cccc1OC	C12H19NO	unknown
+CNC(C)Cc1cccc(OC)c1C	C12H19NO	unknown
+CNC(C)Cc1cc(C)cc(OC)c1	C12H19NO	unknown
+CNC(C)Cc1cc(OC)ccc1C	C12H19NO	unknown
+CNC(C)Cc1ccc(OC)cc1C	C12H19NO	unknown
+COc1c(C)cccc1CC(C)N(C)C(=O)C(F)(F)C(F)(F)F	C15H18F5NO2	unknown
+COc1ccc(C)cc1CC(C)N(C)C(=O)C(F)(F)C(F)(F)F	C15H18F5NO2	unknown
+COc1cccc(C)c1CC(C)N(C)C(=O)C(F)(F)C(F)(F)F	C15H18F5NO2	unknown
+COc1cccc(CC(C)N(C)C(=O)C(F)(F)C(F)(F)F)c1C	C15H18F5NO2	unknown
+COc1cc(C)cc(CC(C)N(C)C(=O)C(F)(F)C(F)(F)F)c1	C15H18F5NO2	unknown
+COc1ccc(C)c(CC(C)N(C)C(=O)C(F)(F)C(F)(F)F)c1	C15H18F5NO2	unknown
+COc1ccc(CC(C)N(C)C(=O)C(F)(F)C(F)(F)F)c(C)c1	C15H18F5NO2	unknown
+COc1c(C)cccc1CC(C)N(C)C(=O)C(F)(F)C(F)(F)C(F)(F)F	C16H18F7NO2	unknown
+COc1ccc(C)cc1CC(C)N(C)C(=O)C(F)(F)C(F)(F)C(F)(F)F	C16H18F7NO2	unknown
+COc1cccc(C)c1CC(C)N(C)C(=O)C(F)(F)C(F)(F)C(F)(F)F	C16H18F7NO2	unknown
+COc1cccc(CC(C)N(C)C(=O)C(F)(F)C(F)(F)C(F)(F)F)c1C	C16H18F7NO2	unknown
+COc1cc(C)cc(CC(C)N(C)C(=O)C(F)(F)C(F)(F)C(F)(F)F)c1	C16H18F7NO2	unknown
+COc1ccc(C)c(CC(C)N(C)C(=O)C(F)(F)C(F)(F)C(F)(F)F)c1	C16H18F7NO2	unknown
+COc1ccc(CC(C)N(C)C(=O)C(F)(F)C(F)(F)C(F)(F)F)c(C)c1	C16H18F7NO2	unknown
+CCOc1ccccc1CC(C)NC	C12H19NO	unknown
+CCNCCc1ccccc1OCC	C12H19NO	unknown
+CCOc1ccccc1CC(C)(C)N	C12H19NO	unknown
+CCOc1ccccc1CC(N)CC	C12H19NO	unknown
+CCOc1ccccc1CC(C)N(C)C(=O)C(F)(F)C(F)(F)C(F)(F)F	C16H18F7NO2	unknown
+CCOc1cccc(CC(C)N(C)C(=O)C(F)(F)C(F)(F)C(F)(F)F)c1	C16H18F7NO2	unknown
+CCOc1ccc(CC(C)N(C)C(=O)C(F)(F)C(F)(F)C(F)(F)F)cc1	C16H18F7NO2	unknown
+CCOc1ccccc1CCN(CC)C(=O)C(F)(F)C(F)(F)C(F)(F)F	C16H18F7NO2	unknown
+CCOc1ccccc1CC(C)(C)NC(=O)C(F)(F)C(F)(F)C(F)(F)F	C16H18F7NO2	unknown
+CCOc1ccccc1CC(CC)NC(=O)C(F)(F)C(F)(F)C(F)(F)F	C16H18F7NO2	unknown
+CCOc1ccccc1CC(C)N(C)C(=O)C(F)(F)C(F)(F)F	C15H18F5NO2	unknown
+CCOc1cccc(CC(C)N(C)C(=O)C(F)(F)C(F)(F)F)c1	C15H18F5NO2	unknown
+CCOc1ccc(CC(C)N(C)C(=O)C(F)(F)C(F)(F)F)cc1	C15H18F5NO2	unknown
+CCOc1ccccc1CCN(CC)C(=O)C(F)(F)C(F)(F)F	C15H18F5NO2	unknown
+CCOc1ccccc1CC(C)(C)NC(=O)C(F)(F)C(F)(F)F	C15H18F5NO2	unknown
+CCOc1ccccc1CC(CC)NC(=O)C(F)(F)C(F)(F)F	C15H18F5NO2	unknown
+CCCC(Cc1ccc2c(c1)OCO2)NC(=O)C(F)(F)C(F)(F)F	C15H16F5NO3	unknown
+CC(C)C(Cc1ccc2c(c1)OCO2)NC(=O)C(F)(F)C(F)(F)F	C15H16F5NO3	unknown
+CCC(C)(Cc1ccc2c(c1)OCO2)NC(=O)C(F)(F)C(F)(F)F	C15H16F5NO3	unknown
+CCCN(CCc1ccc2c(c1)OCO2)C(=O)C(F)(F)C(F)(F)F	C15H16F5NO3	unknown
+CC(C)N(CCc1ccc2c(c1)OCO2)C(=O)C(F)(F)C(F)(F)F	C15H16F5NO3	unknown
+CCN(C(=O)C(F)(F)C(F)(F)F)C(C)Cc1ccc2c(c1)OCO2	C15H16F5NO3	unknown
+CCC(Cc1ccc2c(c1)OCO2)N(C)C(=O)C(F)(F)C(F)(F)F	C15H16F5NO3	unknown
+CN(C(=O)C(F)(F)C(F)(F)F)C(C)(C)Cc1ccc2c(c1)OCO2	C15H16F5NO3	unknown
+CCCC(Cc1ccc2c(c1)OCO2)NC(=O)C(F)(F)F	C14H16F3NO3	unknown
+CC(C)C(Cc1ccc2c(c1)OCO2)NC(=O)C(F)(F)F	C14H16F3NO3	unknown
+CCC(C)(Cc1ccc2c(c1)OCO2)NC(=O)C(F)(F)F	C14H16F3NO3	unknown
+CCN(C(=O)C(F)(F)F)C(C)Cc1ccc2c(c1)OCO2	C14H16F3NO3	unknown
+CCCN(CCc1ccc2c(c1)OCO2)C(=O)C(F)(F)C(F)(F)C(F)(F)F	C16H16F7NO3	unknown
+CC(C)N(CCc1ccc2c(c1)OCO2)C(=O)C(F)(F)C(F)(F)C(F)(F)F	C16H16F7NO3	unknown
+CCC(Cc1ccc2c(c1)OCO2)N(C)C(=O)C(F)(F)C(F)(F)C(F)(F)F	C16H16F7NO3	unknown
+CN(C(=O)C(F)(F)C(F)(F)C(F)(F)F)C(C)(C)Cc1ccc2c(c1)OCO2	C16H16F7NO3	unknown
+CCC(=O)N(C)C(C)Cc1ccc2c(c1)OCO2	C14H19NO3	unknown
+CCCC(=O)N(C)C(C)Cc1ccc2c(c1)OCO2	C15H21NO3	unknown
+CC(Cc1ccc2c(c1)OCO2)N(C)C(=O)c1ccccc1	C18H19NO3	unknown
+CC(Cc1ccc2c(c1)OCO2)N(C)C(=O)C(F)(F)F	C13H14F3NO3	unknown
+CC(Cc1ccc2c(c1)OCO2)N(C)C(=O)c1c(F)c(F)c(F)c(F)c1F	C18H14F5NO3	unknown
+CCCCCN1CCC(C(=O)OCC)(c2ccccc2)CC1	C19H29NO2	unknown
+CCCCCCN1CCC(C(=O)OCC)(c2ccccc2)CC1	C20H31NO2	unknown
+CCCCCCCN1CCC(C(=O)OCC)(c2ccccc2)CC1	C21H33NO2	unknown
+CCCCCCCCN1CCC(C(=O)OCC)(c2ccccc2)CC1	C22H35NO2	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCO)CC1	C16H23NO3	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCCO)CC1	C17H25NO3	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCCCO)CC1	C18H27NO3	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCCCCO)CC1	C19H29NO3	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCCCCCO)CC1	C20H31NO3	unknown
+CCOCCN1CCC(C(=O)OCC)(c2ccccc2)CC1	C18H27NO3	unknown
+CCOCCCN1CCC(C(=O)OCC)(c2ccccc2)CC1	C19H29NO3	unknown
+CCOCCCCN1CCC(C(=O)OCC)(c2ccccc2)CC1	C20H31NO3	unknown
+CCOCCCCCN1CCC(C(=O)OCC)(c2ccccc2)CC1	C21H33NO3	unknown
+CCOCCCCCCN1CCC(C(=O)OCC)(c2ccccc2)CC1	C22H35NO3	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCOC)CC1	C17H25NO3	unknown
+CCCOCCN1CCC(C(=O)OCC)(c2ccccc2)CC1	C19H29NO3	unknown
+CCCCOCCN1CCC(C(=O)OCC)(c2ccccc2)CC1	C20H31NO3	unknown
+CCCCCOCCN1CCC(C(=O)OCC)(c2ccccc2)CC1	C21H33NO3	unknown
+CCCCCCOCCN1CCC(C(=O)OCC)(c2ccccc2)CC1	C22H35NO3	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCCOCC2CCCO2)CC1	C22H33NO4	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCCCOCC2CCCO2)CC1	C23H35NO4	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CC2CCCO2)CC1	C19H27NO3	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCC2CCCO2)CC1	C20H29NO3	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCCC2CCCO2)CC1	C21H31NO3	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCCCC2CCCO2)CC1	C22H33NO3	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCCCCC2CCCO2)CC1	C23H35NO3	unknown
+CCOC(=O)C1(c2ccccc2)CCN(C2CCCC2)CC1	C19H27NO2	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CC2CCCC2)CC1	C20H29NO2	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCC2CCCC2)CC1	C21H31NO2	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCCC2CCCC2)CC1	C22H33NO2	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCCCC2CCCC2)CC1	C23H35NO2	unknown
+Cc1ccccc1C1(N2CCCCC2)CCCCC1	C18H27N	arylcycloalkylamine
+Clc1cccc(C2(N3CCCCC3)CCCCC2)c1	C17H24ClN	arylcycloalkylamine
+Brc1ccc(C2(N3CCCCC3)CCCCC2)cc1	C17H24BrN	arylcycloalkylamine
+c1ccc(Oc2ccc(C3(N4CCCCC4)CCCCC3)cc2)cc1	C23H29NO	arylcycloalkylamine
+c1ccc2c(C3(N4CCCCC4)CCCCC3)cccc2c1	C21H27N	arylcycloalkylamine
+c1ccc2c(c1)-c1ccccc1C2C1(N2CCCCC2)CCCCC1	C24H29N	unknown
+CCC1(C)CCN(C2(c3ccccc3)CCCCC2)C1	C19H29N	arylcycloalkylamine
+CCN(C)C1(c2ccccc2)CCCCC1	C15H23N	arylcycloalkylamine
+CCN(C)C1(c2cccc(C)c2)CCCCC1	C16H25N	arylcycloalkylamine
+CCN(C)C1(c2ccc(OC)cc2)CCCCC1	C16H25NO	arylcycloalkylamine
+CCN(CC)CCN(C)C1(c2ccccc2)CCCCC1	C19H32N2	arylcycloalkylamine
+CCN(CC)C1(c2ccc(C)cc2)CCCCC1	C17H27N	arylcycloalkylamine
+CCN(CC)C1(c2ccc(Cl)cc2)CCCCC1	C16H24ClN	arylcycloalkylamine
+c1ccc(CNC2(c3ccccc3)CCCCC2)cc1	C19H23N	arylcycloalkylamine
+CN(C)CCCNC1(c2ccccc2)CCCCC1	C17H28N2	arylcycloalkylamine
+CCN(CC)CCNC1(c2ccccc2)CCCCC1	C18H30N2	arylcycloalkylamine
+c1ccc(C2(NCCN3CCOCC3)CCCCC2)cc1	C18H28N2O	arylcycloalkylamine
+c1ccc(C2(NCCOC3CCCCO3)CCCCC2)cc1	C19H29NO2	arylcycloalkylamine
+c1ccc(C2(NCCCOC3CCCCO3)CCCCC2)cc1	C20H31NO2	arylcycloalkylamine
+COCCCCCNC1(c2ccccc2)CCCCC1	C18H29NO	arylcycloalkylamine
+CSCCCNC1(c2ccccc2)CCCCC1	C16H25NS	arylcycloalkylamine
+CCOC(CNC1(c2ccccc2)CCCCC1)OCC	C18H29NO2	arylcycloalkylamine
+CNC1(c2ccccc2C)CCCCC1	C14H21N	arylcycloalkylamine
+CNC1(c2cccc(C)c2)CCCCC1	C14H21N	arylcycloalkylamine
+CCNC1(c2ccccc2C)CCCCC1	C15H23N	arylcycloalkylamine
+CCNC1(c2cccc(C)c2)CCCCC1	C15H23N	arylcycloalkylamine
+Cc1cccc(C2(NCc3ccccc3)CCCCC2)c1	C20H25N	arylcycloalkylamine
+CCNC1(c2cccc(Cl)c2)CCCCC1	C14H20ClN	arylcycloalkylamine
+CCNC1(c2ccc(Cl)cc2)CCCCC1	C14H20ClN	arylcycloalkylamine
+CCNC1(c2ccc(OC)cc2)CCCCC1	C15H23NO	arylcycloalkylamine
+CCNC1(c2ccc(N(CC)CC)cc2)CCCCC1	C18H30N2	arylcycloalkylamine
+CCNC1(c2ccc(OC)c(OC)c2)CCCCC1	C16H25NO2	arylcycloalkylamine
+Cc1cccc(C2(N)CCCCC2)c1	C13H19N	arylcycloalkylamine
+CCOC1(c2ccccc2)CCN(CCc2ccccc2)CC1	C21H27NO	unknown
+CCOC1(c2ccco2)CCN(CCc2ccccc2)CC1	C19H25NO2	unknown
+COC1(c2ccccc2)CCN(CCc2ccccc2)CC1C	C21H27NO	unknown
+COC1(c2ccco2)CCN(CCc2ccccc2)CC1C	C19H25NO2	unknown
+COC1(c2ccccc2)CCN(C)CC1C	C14H21NO	unknown
+CC1CN(CCC(=O)c2ccccc2)CCC1(O)c1ccccc1	C21H25NO2	unknown
+CC1CN(CCC(=O)c2ccccc2)CCC1(O)c1ccco1	C19H23NO3	unknown
+CCOC1(c2ccccc2)CCN(CCC(=O)c2ccccc2)CC1	C22H27NO2	unknown
+CCOC1(c2ccco2)CCN(CCC(=O)c2ccccc2)CC1	C20H25NO3	unknown
+CCOC1(c2cccc(C)c2)CCN(CCc2ccccc2)CC1	C22H29NO	unknown
+CCOC1(c2ccc(F)cc2)CCN(CCc2ccccc2)CC1	C21H26FNO	unknown
+CC(=O)OC1(c2ccccn2)CCN(CCc2ccccc2)CC1	C20H24N2O2	unknown
+CCC(=O)OC1(c2ccccn2)CCN(CCc2ccccc2)CC1	C21H26N2O2	unknown
+COc1ccccc1C1(OC(C)=O)CCN(CCc2ccccc2)CC1	C22H27NO3	unknown
+COc1cccc(C2(OC(C)=O)CCN(CCc3ccccc3)CC2)c1	C22H27NO3	unknown
+O=C(OC1(c2ccccc2)CCN(CCc2ccccc2)CC1)c1ccc([N+](=O)[O-])cc1	C26H26N2O4	unknown
+CCC(=O)OC1(c2ccc([N+](=O)[O-])cc2)CCN(C)CC1C	C16H22N2O4	unknown
+COC1(c2ccco2)CCN(CCc2ccccc2)CC1	C18H23NO2	unknown
+CCOC1(c2ccco2)CCN(CCc2ccccc2)CC1C	C20H27NO2	unknown
+CCCOC1(c2ccco2)CCN(CCc2ccccc2)CC1C	C21H29NO2	unknown
+CCCCOC1(c2ccco2)CCN(CCc2ccccc2)CC1C	C22H31NO2	unknown
+CC1CN(CCc2ccccc2)CCC1(OCCCl)c1ccco1	C20H26ClNO2	unknown
+CCOC1(c2ccco2)CCN(CCCC(=O)c2ccccc2)CC1	C21H27NO3	unknown
+CCOC1(c2ccco2)CCN(CCC(CO)c2ccccc2)CC1	C21H29NO3	unknown
+CCOC1(c2ccco2)CCN(CCC(=O)c2ccccc2)CC1C	C21H27NO3	unknown
+CC(=O)OC1(c2ccco2)CCN(CCc2ccccc2)CC1	C19H23NO3	unknown
+CCC(=O)OC1(c2ccco2)CCN(CCc2ccccc2)CC1	C20H25NO3	unknown
+CCOC1(c2cccs2)CCN(CCc2ccccc2)CC1	C19H25NOS	unknown
+CN1CC[C@]23c4c5ccc(O)c4O[C@H]2[C@@H](O)C=C[C@H]3[C@H]1C5	C17H19NO3	unknown
+C=CCN1CC[C@]23c4c5ccc(O)c4O[C@H]2[C@@H](O)C=C[C@H]3[C@H]1C5	C19H21NO3	unknown
+FC(F)(F)c1ccc(N2CCNCC2)nc1Cl	C10H11ClF3N3	unknown
+CN(C)[C@@H]1Cc2ccccc2[C@@H](c2cccc(Br)c2)C1	C18H20BrN	unknown
+CN(C)C1Cc2ccccc2C(c2ccccc2)C1	C18H21N	unknown
+CN(C)C1Cc2ccccc2C(c2cccc(F)c2)C1	C18H20FN	unknown
+CN(C)C1Cc2ccccc2C(c2cccc(Cl)c2)C1	C18H20ClN	unknown
+CN(C)C1Cc2ccccc2C(c2cccc(Br)c2)C1	C18H20BrN	unknown
+CN(C)C1Cc2ccccc2C(c2cccc(C(F)(F)F)c2)C1	C19H20F3N	unknown
+CN(C)C1Cc2ccccc2C(c2cccc([N+](=O)[O-])c2)C1	C18H20N2O2	unknown
+CN(C)C1Cc2ccccc2C(c2ccc(F)cc2)C1	C18H20FN	unknown
+CN(C)C1Cc2ccccc2C(c2ccc(Cl)cc2)C1	C18H20ClN	unknown
+CN(C)C1Cc2ccccc2C(c2ccc(Br)cc2)C1	C18H20BrN	unknown
+CN(C)C1Cc2ccccc2C(c2ccc(C(F)(F)F)cc2)C1	C19H20F3N	unknown
+CN(C)C1Cc2ccccc2C(c2ccc([N+](=O)[O-])cc2)C1	C18H20N2O2	unknown
+CN(C)C1Cc2ccccc2C(c2ccccc2Br)C1	C18H20BrN	unknown
+CN(C)C1Cc2ccccc2C(C2CCCCC2)C1	C18H27N	unknown
+CN(C)C1Cc2ccccc2C(C2CCCCCCC2)C1	C20H31N	unknown
+CN(C)C1Cc2ccccc2C(c2cccc(-c3ccccc3)c2)C1	C24H25N	unknown
+CN(C)C1Cc2ccccc2C(c2ccccc2Cl)C1	C18H20ClN	unknown
+Cc1ccccc1C1CC(N(C)C)Cc2ccccc21	C19H23N	unknown
+CCCC(Br)C(=O)c1ccc2c(c1)OCO2	C12H13BrO3	unknown
+CCCC(Br)C(=O)c1cc2c(cc1OC)OCO2	C13H15BrO4	unknown
+CCCC(C(=O)c1c(OC)cc2c(c1Br)OCO2)N1CCCC1	C17H22BrNO4	beta-ketone
+CCCC(C(=O)c1cc2c(c(Br)c1OC)OCO2)N1CCCC1	C17H22BrNO4	beta-ketone
+CCCC(C(=O)c1cc(OC)c2c(c1Br)OCO2)N1CCCC1	C17H22BrNO4	beta-ketone
+CCCC(C(=O)c1cc2c(c(OC)c1Br)OCO2)N1CCCC1	C17H22BrNO4	beta-ketone
+CCCC(C(=O)c1cc(Br)c2c(c1OC)OCO2)N1CCCC1	C17H22BrNO4	beta-ketone
+CCCC(C(=O)c1cc(OC)c(Br)c2c1OCO2)N1CCCC1	C17H22BrNO4	beta-ketone
+CCCC(C(=O)c1c(Br)cc(OC)c2c1OCO2)N1CCCC1	C17H22BrNO4	beta-ketone
+CCCC(C(=O)c1c(Br)c(OC)cc2c1OCO2)N1CCCC1	C17H22BrNO4	beta-ketone
+CCCC(C(=O)c1c(OC)cc(Br)c2c1OCO2)N1CCCC1	C17H22BrNO4	beta-ketone
+CCCC(C(=O)c1c(OC)c(Br)cc2c1OCO2)N1CCCC1	C17H22BrNO4	beta-ketone
+CCCC(C(=O)c1c(Br)cc2c(c1OC)OCO2)N1CCCC1	C17H22BrNO4	beta-ketone
+Clc1cccc(N2CCN(CCc3ccccc3)CC2)c1	C18H21ClN2	unknown
+Cc1cc(O)ccc1C1(N2CCCCC2)CCCCC1	C18H27NO	arylcycloalkylamine
+Cc1cc(O)ccc1C1(N2CCC(O)CC2)CCCCC1	C18H27NO2	arylcycloalkylamine
+CC(Cc1cccs1)N(C)C(=O)C(F)(F)F	C10H12F3NOS	unknown
+CC(Cc1cccs1)N(C)C(=O)C(F)(F)C(F)(F)F	C11H12F5NOS	unknown
+CC(Cc1cccs1)N(C)[Si](C)(C)C	C11H21NSSi	unknown
+CCOC(=O)C1(c2ccccc2C)CCN(C)CC1	C16H23NO2	unknown
+CC(=O)OC1(c2ccccc2C)CCN(CCc2ccccc2)CC1C	C23H29NO2	unknown
+CC(=O)OC1(c2ccco2)CCN(CCc2ccccc2)CC1C	C20H25NO3	unknown
+CCC(=O)OC1(c2ccco2)CCN(CCc2ccccc2)CC1C	C21H27NO3	unknown
+CC(=O)OC1(c2cccs2)CCN(CCc2ccccc2)CC1C	C20H25NO2S	unknown
+CC(=O)OC1(c2ccccn2)CCN(CCc2ccccc2)CC1C	C21H26N2O2	unknown
+CCC(=O)OC1(c2ccccn2)CCN(CCc2ccccc2)CC1C	C22H28N2O2	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CC(=O)c2ccccc2)CC1	C22H25NO3	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CC(=O)c2cc(C)ccc2C)CC1	C24H29NO3	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CC(=O)c2cccc(OC)c2)CC1	C23H27NO4	unknown
+COC(=O)C1(c2ccccc2)CCN(CCCC(=O)c2ccccc2)CC1	C23H27NO3	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCCC(=O)c2ccccc2)CC1	C24H29NO3	unknown
+C=CCOC(=O)C1(c2ccccc2)CCN(CCCC(=O)c2ccccc2)CC1	C25H29NO3	unknown
+CCCOC(=O)C1(c2ccccc2)CCN(CCCC(=O)c2ccccc2)CC1	C25H31NO3	unknown
+CC(C)OC(=O)C1(c2ccccc2)CCN(CCCC(=O)c2ccccc2)CC1	C25H31NO3	unknown
+CCCCOC(=O)C1(c2ccccc2)CCN(CCCC(=O)c2ccccc2)CC1	C26H33NO3	unknown
+CCC(C)OC(=O)C1(c2ccccc2)CCN(CCCC(=O)c2ccccc2)CC1	C26H33NO3	unknown
+CCCCCOC(=O)C1(c2ccccc2)CCN(CCCC(=O)c2ccccc2)CC1	C27H35NO3	unknown
+O=C(CCCN1CCC(C(=O)OC2CCCCC2)(c2ccccc2)CC1)c1ccccc1	C28H35NO3	unknown
+O=C(CCCN1CCC(C(=O)OCCc2ccccc2)(c2ccccc2)CC1)c1ccccc1	C30H33NO3	unknown
+COC(=O)C1(c2ccccc2)CCN(CCCC(=O)c2ccc(F)cc2)CC1	C23H26FNO3	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCCC(=O)c2ccc(F)cc2)CC1	C24H28FNO3	unknown
+CCCOC(=O)C1(c2ccccc2)CCN(CCCC(=O)c2ccc(F)cc2)CC1	C25H30FNO3	unknown
+CC(C)OC(=O)C1(c2ccccc2)CCN(CCCC(=O)c2ccc(F)cc2)CC1	C25H30FNO3	unknown
+COC(=O)C1(c2ccccc2)CCN(CCCC(=O)c2ccc(Cl)cc2)CC1	C23H26ClNO3	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCCC(=O)c2ccc(Cl)cc2)CC1	C24H28ClNO3	unknown
+CCCOC(=O)C1(c2ccccc2)CCN(CCCC(=O)c2ccc(Cl)cc2)CC1	C25H30ClNO3	unknown
+CC(C)OC(=O)C1(c2ccccc2)CCN(CCCC(=O)c2ccc(Cl)cc2)CC1	C25H30ClNO3	unknown
+COC(=O)C1(c2ccccc2)CCN(CCCC(=O)c2ccc(C)cc2)CC1	C24H29NO3	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCCC(=O)c2ccc(C)cc2)CC1	C25H31NO3	unknown
+CCCOC(=O)C1(c2ccccc2)CCN(CCCC(=O)c2ccc(C)cc2)CC1	C26H33NO3	unknown
+Cc1ccc(C(=O)CCCN2CCC(C(=O)OC(C)C)(c3ccccc3)CC2)cc1	C26H33NO3	unknown
+COC(=O)C1(c2ccccc2)CCN(CCCC(=O)c2ccc(OC)cc2)CC1	C24H29NO4	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCCC(=O)c2ccc(OC)cc2)CC1	C25H31NO4	unknown
+CCCOC(=O)C1(c2ccccc2)CCN(CCCC(=O)c2ccc(OC)cc2)CC1	C26H33NO4	unknown
+COc1ccc(C(=O)CCCN2CCC(C(=O)OC(C)C)(c3ccccc3)CC2)cc1	C26H33NO4	unknown
+COC(=O)C1(c2ccccc2)CCN(CCCCC(=O)c2ccccc2)CC1	C24H29NO3	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCCCC(=O)c2ccccc2)CC1	C25H31NO3	unknown
+CCCOC(=O)C1(c2ccccc2)CCN(CCCCC(=O)c2ccccc2)CC1	C26H33NO3	unknown
+CC(C)OC(=O)C1(c2ccccc2)CCN(CCCCC(=O)c2ccccc2)CC1	C26H33NO3	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCCCC(=O)c2ccc(Cl)cc2)CC1	C25H30ClNO3	unknown
+CCOC(=O)C1(c2ccccc2)CCN(C(C)C(=O)c2ccccc2)CC1	C23H27NO3	unknown
+CCOC(=O)C1(c2ccccc2)CCN(C(C)CC(=O)c2ccccc2)CC1	C24H29NO3	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CC(C)C(=O)c2ccccc2)CC1	C24H29NO3	unknown
+CCOC(=O)C1(c2ccccc2)CCN(C(CC(=O)c2ccccc2)c2ccccc2)CC1	C29H31NO3	unknown
+COC(=O)C1(c2ccccc2)CCN(CCC(=O)c2ccccc2)CC1	C22H25NO3	unknown
+C=CCOC(=O)C1(c2ccccc2)CCN(CCC(=O)c2ccccc2)CC1	C24H27NO3	unknown
+CCCOC(=O)C1(c2ccccc2)CCN(CCC(=O)c2ccccc2)CC1	C24H29NO3	unknown
+CC(C)OC(=O)C1(c2ccccc2)CCN(CCC(=O)c2ccccc2)CC1	C24H29NO3	unknown
+CCCCOC(=O)C1(c2ccccc2)CCN(CCC(=O)c2ccccc2)CC1	C25H31NO3	unknown
+CCC(C)OC(=O)C1(c2ccccc2)CCN(CCC(=O)c2ccccc2)CC1	C25H31NO3	unknown
+CCCCCOC(=O)C1(c2ccccc2)CCN(CCC(=O)c2ccccc2)CC1	C26H33NO3	unknown
+CCCCCCOC(=O)C1(c2ccccc2)CCN(CCC(=O)c2ccccc2)CC1	C27H35NO3	unknown
+O=C(CCN1CCC(C(=O)OC2CCCCC2)(c2ccccc2)CC1)c1ccccc1	C27H33NO3	unknown
+CCCCCCCOC(=O)C1(c2ccccc2)CCN(CCC(=O)c2ccccc2)CC1	C28H37NO3	unknown
+O=C(CCN1CCC(C(=O)OCCc2ccccc2)(c2ccccc2)CC1)c1ccccc1	C29H31NO3	unknown
+COC(=O)C1(c2ccccc2)CCN(CCC(=O)c2ccc(F)cc2)CC1	C22H24FNO3	unknown
+CC(C)OC(=O)C1(c2ccccc2)CCN(CCC(=O)c2ccc(F)cc2)CC1	C24H28FNO3	unknown
+COC(=O)C1(c2ccccc2)CCN(CCC(=O)c2cccc(Br)c2)CC1	C22H24BrNO3	unknown
+CC(C)OC(=O)C1(c2ccccc2)CCN(CCC(=O)c2cccc(Br)c2)CC1	C24H28BrNO3	unknown
+COC(=O)C1(c2ccccc2)CCN(CCC(=O)c2ccc(C)cc2)CC1	C23H27NO3	unknown
+CCCOC(=O)C1(c2ccccc2)CCN(CCC(=O)c2ccc(C)cc2)CC1	C25H31NO3	unknown
+Cc1ccc(C(=O)CCN2CCC(C(=O)OC(C)C)(c3ccccc3)CC2)cc1	C25H31NO3	unknown
+CCCCOC(=O)C1(c2ccccc2)CCN(CCC(=O)c2ccc(C)cc2)CC1	C26H33NO3	unknown
+COC(=O)C1(c2ccccc2)CCN(CCC(=O)c2cc(C)ccc2C)CC1	C24H29NO3	unknown
+Cc1ccc(C)c(C(=O)CCN2CCC(C(=O)OC(C)C)(c3ccccc3)CC2)c1	C26H33NO3	unknown
+CCc1ccc(C(=O)CCN2CCC(C(=O)OC)(c3ccccc3)CC2)cc1	C24H29NO3	unknown
+CCc1ccc(C(=O)CCN2CCC(C(=O)OC(C)C)(c3ccccc3)CC2)cc1	C26H33NO3	unknown
+COC(=O)C1(c2ccccc2)CCN(CCC(=O)c2ccccc2O)CC1	C22H25NO4	unknown
+CCCOC(=O)C1(c2ccccc2)CCN(CCC(=O)c2ccccc2O)CC1	C24H29NO4	unknown
+CC(C)OC(=O)C1(c2ccccc2)CCN(CCC(=O)c2ccccc2O)CC1	C24H29NO4	unknown
+CCCCOC(=O)C1(c2ccccc2)CCN(CCC(=O)c2ccccc2O)CC1	C25H31NO4	unknown
+COC(=O)C1(c2ccccc2)CCN(CCC(=O)c2ccc(OC)cc2)CC1	C23H27NO4	unknown
+COc1ccc(C(=O)CCN2CCC(C(=O)OC(C)C)(c3ccccc3)CC2)cc1	C25H31NO4	unknown
+CN1CCC(O)(Cc2ccc(F)cc2)CC1	C13H18FNO	unknown
+CN1CCC(O)(Cc2ccccc2F)CC1	C13H18FNO	unknown
+CCN1CCC(O)(Cc2ccc(F)cc2)CC1	C14H20FNO	unknown
+CCN1CCC(O)(Cc2ccccc2F)CC1	C14H20FNO	unknown
+CCN1CCC(O)(Cc2cccc(F)c2)CC1	C14H20FNO	unknown
+OC1(Cc2ccc(F)cc2)CCN(CCc2ccccc2)CC1	C20H24FNO	unknown
+OC1(Cc2cccc(F)c2)CCN(CCc2ccccc2)CC1	C20H24FNO	unknown
+OC1(Cc2ccccc2F)CCN(CCc2ccccc2)CC1	C20H24FNO	unknown
+CC1CN(CCc2ccccc2)CCC1(O)Cc1ccc(F)cc1	C21H26FNO	unknown
+CCC(=O)OC1(Cc2ccc(F)cc2)CCN(C)CC1	C16H22FNO2	unknown
+CCC(=O)OC1(Cc2ccc(F)cc2)CCN(CC)CC1	C17H24FNO2	unknown
+CC(=O)OC1(Cc2ccc(F)cc2)CCN(CCc2ccccc2)CC1	C22H26FNO2	unknown
+CCC(=O)OC1(Cc2ccc(F)cc2)CCN(CCc2ccccc2)CC1	C23H28FNO2	unknown
+CC(=O)OC1(Cc2cccc(F)c2)CCN(CCc2ccccc2)CC1	C22H26FNO2	unknown
+CCC(=O)OC1(Cc2cccc(F)c2)CCN(CCc2ccccc2)CC1	C23H28FNO2	unknown
+CC(=O)OC1(Cc2ccccc2F)CCN(CCc2ccccc2)CC1	C22H26FNO2	unknown
+CCC(=O)OC1(Cc2ccccc2F)CCN(CCc2ccccc2)CC1	C23H28FNO2	unknown
+CC(=O)OC1(Cc2ccc(F)cc2)CCN(CCc2ccccc2)CC1C	C23H28FNO2	unknown
+OC1(Cc2ccccc2)CCN(CCc2ccccc2)CC1	C20H25NO	unknown
+OC1(c2ccccc2)CCN(CCc2ccccc2)CC1	C19H23NO	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCC(=O)c2cccc(F)c2)CC1	C23H26FNO3	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCC(=O)c2ccc(F)cc2)CC1	C23H26FNO3	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCC(=O)c2ccccc2Cl)CC1	C23H26ClNO3	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCC(=O)c2cccc(Cl)c2)CC1	C23H26ClNO3	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCC(=O)c2ccc(Cl)cc2)CC1	C23H26ClNO3	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCC(=O)c2cccc(Br)c2)CC1	C23H26BrNO3	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCC(=O)c2ccc(Br)cc2)CC1	C23H26BrNO3	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCC(=O)c2ccc(I)cc2)CC1	C23H26INO3	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCC(=O)c2ccccc2C)CC1	C24H29NO3	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCC(=O)c2cccc(C)c2)CC1	C24H29NO3	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCC(=O)c2ccc(C)cc2)CC1	C24H29NO3	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCC(=O)c2ccc(C)cc2C)CC1	C25H31NO3	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCC(=O)c2cc(C)ccc2C)CC1	C25H31NO3	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCC(=O)c2ccc(CC)cc2)CC1	C25H31NO3	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCC(=O)c2ccc(C(C)(C)C)cc2)CC1	C27H35NO3	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCC(=O)c2ccccc2O)CC1	C23H27NO4	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCC(=O)c2cccc(O)c2)CC1	C23H27NO4	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCC(=O)c2ccc(O)cc2)CC1	C23H27NO4	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCC(=O)c2cc(O)ccc2O)CC1	C23H27NO5	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCC(=O)c2ccc(C)cc2O)CC1	C24H29NO4	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCC(=O)c2ccc(O)cc2C)CC1	C24H29NO4	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCC(=O)c2ccccc2OC)CC1	C24H29NO4	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCC(=O)c2cccc(OC)c2)CC1	C24H29NO4	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCC(=O)c2ccc(OC)cc2)CC1	C24H29NO4	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCC(=O)c2cc(OC)c(OC)c(OC)c2)CC1	C26H33NO6	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCC(=O)c2cc(OC)c(O)c(OC)c2)CC1	C25H31NO6	unknown
+CCCOc1ccc(C(=O)CCN2CCC(C(=O)OCC)(c3ccccc3)CC2)cc1	C26H33NO4	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCC(=O)c2cccc(C(=O)OC)c2)CC1	C25H29NO5	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCC(=O)c2ccccc2[N+](=O)[O-])CC1	C23H26N2O5	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCC(=O)c2cccc([N+](=O)[O-])c2)CC1	C23H26N2O5	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCC(=O)c2ccc([N+](=O)[O-])cc2)CC1	C23H26N2O5	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCC(=O)c2cccc(C#N)c2)CC1	C24H26N2O3	unknown
+C#Cc1ccc(C(=O)CCN2CCC(C(=O)OCC)(c3ccccc3)CC2)cc1	C25H27NO3	unknown
+C#CCc1ccc(C(=O)CCN2CCC(C(=O)OCC)(c3ccccc3)CC2)cc1	C26H29NO3	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCC(=O)c2ccc(C(=O)OC)cc2)CC1	C25H29NO5	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCC(=O)c2cc(C(C)=O)cc(C(C)=O)c2)CC1	C27H31NO5	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCC(=O)c2ccc(NC(C)=O)cc2)CC1	C25H30N2O4	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCC(=O)c2cccc(N(C)C)c2)CC1	C25H32N2O3	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCC(=O)c2ccc(N(CC)CC)cc2)CC1	C27H36N2O3	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCC(=O)c2cccc(N3CCCCC3)c2)CC1	C28H36N2O3	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCC(=O)c2ccc(N3CCCCC3)cc2)CC1	C28H36N2O3	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CCC(=O)c2ccc(OCCN(C)C)cc2)CC1	C27H36N2O4	unknown
+COc1ccc2c3c1O[C@H]1[C@@H](O)C=C[C@H]4[C@@H](C2)N(C)CC[C@@]341	C18H21NO3	unknown
+CCC(=O)C(CC(C)N(C)C)(c1ccccc1)c1ccccc1	C21H27NO	unknown
+CC(=O)Oc1ccc2c3c1O[C@H]1[C@@H](OC(C)=O)C=C[C@H]4[C@@H](C2)N(C)CC[C@@]341	C21H23NO5	unknown
+C[C@H](CN1CCOCC1)C(C(=O)N1CCCC1)(c1ccccc1)c1ccccc1	C25H32N2O2	unknown
+CCC(=O)N(c1ccccc1C)C1(C(=O)OC)CCN(CCc2ccccc2)CC1	C25H32N2O3	fentanyl
+CC(=O)N(c1ccccc1)C1CCN(CCOc2ccccc2)CC1C	C22H28N2O2	fentanyl
+CNC(C(C)=O)c1ccc(Br)cc1	C10H12BrNO	unknown
+CC(Cc1ccccc1)N(C)C(=O)OC(C)(C)C	C15H23NO2	unknown
+CC(C(O)c1ccccc1)N(C)C(=O)OC(C)(C)C	C15H23NO3	unknown
+Cc1ccc(C(=O)C(C)N(C)C(=O)OC(C)(C)C)cc1	C16H23NO3	beta-ketone
+CNCC(C)Cc1ccc2c(c1)OCO2	C12H17NO2	unknown
+CCC(C)C(NC(=O)c1c2ccccc2nn1CCCCCF)C(N)=O	C19H27FN4O2	unknown
+CCC(C)C(NC(=O)c1nn(CCCCCF)c2ccccc12)C(N)=O	C19H27FN4O2	cannabinoid
+CC(C)C(NC(=O)c1nn(Cc2cccc(F)c2)c2ccccc12)C(N)=O	C20H21FN4O2	cannabinoid
+COc1cccc([C@H](O)C2CCN(CCc3ccc(F)cc3)CC2)c1OC	C22H28FNO3	unknown
+COc1ccccc1N1CCN(CCN(C(=O)C2CCCCC2)c2ccccn2)CC1	C25H34N4O2	unknown
+NC(Cc1ccc(Cl)cc1)C(=O)O	C9H10ClNO2	unknown
+CC(C)COC(=O)N(C)C(C)Cc1ccc2c(c1)OCO2	C16H23NO4	unknown
+CCCCOC(=O)N(C)C(C)Cc1ccc2c(c1)OCO2	C16H23NO4	unknown
+C/C(=C\c1ccccc1)CC(C)N	C12H17N	unknown
+CC(C)COc1ccc(CNC(=O)N(Cc2ccc(F)cc2)C2CCN(C)CC2)cc1	C25H34FN3O2	unknown
+CN(C(=O)Cc1ccccc1)[C@H]1CC[C@@]2(CCCO2)C[C@@H]1N1CCCC1	C22H32N2O2	unknown
+COC(=O)[C@@H]1C[C@H](OC(=O)CSC#N)C(=O)[C@H]2[C@@]1(C)CC[C@H]1C(=O)O[C@H](c3ccoc3)C[C@]21C	C24H27NO8S	unknown
+COc1cccc(C2(N)CCCCC2)c1	C13H19NO	arylcycloalkylamine
+COc1ccc(C2(N)CCCCC2)cc1	C13H19NO	arylcycloalkylamine
+COc1ccc(C2(N3CCCC3)CCCCC2)cc1	C17H25NO	arylcycloalkylamine
+Cc1cccc(C2(N3CCCC3)CCCCC2)c1	C17H25N	arylcycloalkylamine
+COc1cc(CCNCc2ccccc2F)c(OC)cc1F	C17H19F2NO2	unknown
+CCCC(C(=O)c1ccc(O)c(OC)c1)N1CCCC1	C16H23NO3	beta-ketone
+CCC(C(=O)c1ccc(C)cc1)N(C)C(=O)c1cc(C)ccc1NC(=O)Nc1ccc(C)cc1	C28H31N3O3	unknown
+Cc1ccc(C(=O)c2cn(CCCCCO)c3ccccc23)c2ccccc12	C25H25NO2	cannabinoid
+CNC(c1ccccc1)C(C)Cl	C10H14ClN	unknown
+CNC(Cc1ccc2c(c1)OCO2)C1CCCCC1	C16H23NO2	unknown
+CNC(Cc1ccccc1)Cc1ccc2c(c1)OCO2	C17H19NO2	unknown
+CNC(Cc1ccc2c(c1)OCO2)c1ccccc1OC	C17H19NO3	unknown
+CNC(Cc1ccc2c(c1)OCO2)c1cccc(OC)c1	C17H19NO3	unknown
+CNC(Cc1ccc2c(c1)OCO2)c1ccc(OC)cc1	C17H19NO3	unknown
+CNC(Cc1ccc2c(c1)OCO2)c1ccc(F)cc1	C16H16FNO2	unknown
+CNC(Cc1ccc2c(c1)OCO2)c1ccccc1C	C17H19NO2	unknown
+CNC(Cc1ccc2c(c1)OCO2)c1cccc(C)c1	C17H19NO2	unknown
+CNC(Cc1ccc2c(c1)OCO2)c1ccc(C)cc1	C17H19NO2	unknown
+CNC(Cc1ccc2c(c1)OCO2)c1cccc2ccccc12	C20H19NO2	unknown
+CNC(Cc1ccc2c(c1)OCO2)c1ccc2ccccc2c1	C20H19NO2	unknown
+CNC(Cc1ccc2c(c1)OCO2)c1ccc(-c2ccccc2)cc1	C22H21NO2	unknown
+COc1cccc(CC(C)NC(=O)C(F)(F)F)c1OC	C13H16F3NO3	unknown
+COc1ccc(CC(C)NC(=O)C(F)(F)F)c(OC)c1	C13H16F3NO3	unknown
+COc1ccc(OC)c(CC(C)NC(=O)C(F)(F)F)c1	C13H16F3NO3	unknown
+COc1cccc(OC)c1CC(C)NC(=O)C(F)(F)F	C13H16F3NO3	unknown
+COc1ccc(CC(C)NC(=O)C(F)(F)F)cc1OC	C13H16F3NO3	unknown
+COc1cc(CC(C)NC(=O)C(F)(F)F)cc(OC)c1	C13H16F3NO3	unknown
+COc1cccc(CC(C)NC(=O)C(F)(F)C(F)(F)F)c1OC	C14H16F5NO3	unknown
+COc1ccc(CC(C)NC(=O)C(F)(F)C(F)(F)F)c(OC)c1	C14H16F5NO3	unknown
+COc1ccc(OC)c(CC(C)NC(=O)C(F)(F)C(F)(F)F)c1	C14H16F5NO3	unknown
+COc1cccc(OC)c1CC(C)NC(=O)C(F)(F)C(F)(F)F	C14H16F5NO3	unknown
+COc1ccc(CC(C)NC(=O)C(F)(F)C(F)(F)F)cc1OC	C14H16F5NO3	unknown
+COc1cc(CC(C)NC(=O)C(F)(F)C(F)(F)F)cc(OC)c1	C14H16F5NO3	unknown
+COc1cccc(CC(C)NC(=O)C(F)(F)C(F)(F)C(F)(F)F)c1OC	C15H16F7NO3	unknown
+COc1ccc(CC(C)NC(=O)C(F)(F)C(F)(F)C(F)(F)F)c(OC)c1	C15H16F7NO3	unknown
+COc1ccc(OC)c(CC(C)NC(=O)C(F)(F)C(F)(F)C(F)(F)F)c1	C15H16F7NO3	unknown
+COc1cccc(OC)c1CC(C)NC(=O)C(F)(F)C(F)(F)C(F)(F)F	C15H16F7NO3	unknown
+COc1ccc(CC(C)NC(=O)C(F)(F)C(F)(F)C(F)(F)F)cc1OC	C15H16F7NO3	unknown
+COc1cc(CC(C)NC(=O)C(F)(F)C(F)(F)C(F)(F)F)cc(OC)c1	C15H16F7NO3	unknown
+CN1CC=C(c2c[nH]c3ccc(C#N)cc23)CC1	C15H15N3	unknown
+CN1CC=C(c2c[nH]c3ccc([N+](=O)[O-])cc23)CC1	C14H15N3O2	unknown
+CN1CC=C(c2c[nH]c3ccc(F)cc23)CC1	C14H15FN2	unknown
+CN1CC=C(c2c[nH]c3ccc(Cl)cc23)CC1	C14H15ClN2	unknown
+Cc1ccc2[nH]cc(C3=CCN(C)CC3)c2c1	C15H18N2	unknown
+CN(C)C1CC=C(c2c[nH]c3ccc(C#N)cc23)CC1	C17H19N3	unknown
+CN(C)C1CC=C(c2c[nH]c3ccc([N+](=O)[O-])cc23)CC1	C16H19N3O2	unknown
+CN(C)C1CC=C(c2c[nH]c3ccc(F)cc23)CC1	C16H19FN2	unknown
+CN(C)C1CC=C(c2c[nH]c3ccc(Br)cc23)CC1	C16H19BrN2	unknown
+CN(C)C1CC=C(c2c[nH]c3ccc(Cl)cc23)CC1	C16H19ClN2	unknown
+CN(C)C1CC=C(c2c[nH]c3ccccc23)CC1	C16H20N2	unknown
+COc1ccc2[nH]cc(C3=CCC(N(C)C)CC3)c2c1	C17H22N2O	unknown
+Cc1ccc2[nH]cc(C3=CCC(N(C)C)CC3)c2c1	C17H22N2	unknown
+CN(C)CC1CC1c1c[nH]c2ccc(C#N)cc12	C15H17N3	unknown
+CN(C)CC1CC1c1c[nH]c2ccc(F)cc12	C14H17FN2	unknown
+C[N+](C)(CCl)CCc1c[nH]c2ccccc12	C13H18ClN2	tryptamine
+COc1cc2c(cc1I)OCCC(NC(=O)C(F)(F)F)C2	C13H13F3INO3	unknown
+COc1cc2c(cc1C(F)(F)F)OCCC(NC(=O)C(F)(F)F)C2	C14H13F6NO3	unknown
+CCCCN(CCC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C23H31N3O	unknown
+CN1C[C@H](C(=O)N[C@]2(C)O[C@@]3(O)[C@@H]4CCCN4C(=O)[C@H](Cc4ccccc4)N3C2=O)C=C2c3cccc4[nH]cc(c34)C[C@H]21	C33H35N5O5	unknown
+CN1C[C@H](C(=O)N[C@]2(C)O[C@@]3(O)[C@@H]4CCCN4C(=O)[C@H](Cc4ccccc4)N3C2=O)CC2c3cccc4[nH]cc(c34)C[C@H]21	C33H37N5O5	unknown
+CCOc1ccc(/C=C/[N+](=O)[O-])c(OCC)c1	C12H15NO4	unknown
+CCOc1cc(OC)ccc1/C=C/[N+](=O)[O-]	C11H13NO4	unknown
+COc1cc(C)c(/C=C/[N+](=O)[O-])c(OC)c1	C11H13NO4	unknown
+CCOc1cc(C)c(/C=C/[N+](=O)[O-])c(OCC)c1	C13H17NO4	unknown
+CCOc1cc(OC)cc(C)c1/C=C/[N+](=O)[O-]	C12H15NO4	unknown
+COc1cc(C)c(/C=C/[N+](=O)[O-])c(C)c1	C11H13NO3	unknown
+CCOc1cc(C)c(/C=C/[N+](=O)[O-])c(C)c1	C12H15NO3	unknown
+COc1cc(C)cc(C)c1/C=C/[N+](=O)[O-]	C11H13NO3	unknown
+CCOc1cc(C)cc(C)c1/C=C/[N+](=O)[O-]	C12H15NO3	unknown
+COc1cc(C)cc(OC)c1/C=C/[N+](=O)[O-]	C11H13NO4	unknown
+COc1cc(Br)cc(/C=C/[N+](=O)[O-])c1OC	C10H10BrNO4	unknown
+COc1cc(/C=C/[N+](=O)[O-])c(OC)c(OC)c1	C11H13NO5	unknown
+COc1ccc(OC)c(OC)c1/C=C/[N+](=O)[O-]	C11H13NO5	unknown
+CC(N)Cc1c[nH]c2ccc(Br)cc12	C11H13BrN2	tryptamine
+CC(N)Cc1c(-c2ccccc2)n(C)c2ccccc12	C18H20N2	tryptamine
+CC(N)Cc1c(-c2ccccc2)[nH]c2ccccc12	C17H18N2	tryptamine
+NC12CCCCC1Cc1ccccc12	C13H17N	arylcycloalkylamine
+c1ccc(C23CCCCC2CCCN3)cc1	C15H21N	arylcycloalkylamine
+c1ccc2c(c1)C1CCC2(N2CCCCC2)CC1	C17H23N	arylcycloalkylamine
+c1ccc2c(c1)C1CCCCC21N1CCCCC1	C17H23N	arylcycloalkylamine
+c1ccc2c(c1)C1CCCC2(N2CCCCC2)C1	C17H23N	arylcycloalkylamine
+c1ccc2c(c1)C1CCC2(N2CCCCC2)C1	C16H21N	arylcycloalkylamine
+c1ccc([C@@]2(N3CCCCC3)C[C@H]3C[C@H]3C2)cc1	C17H23N	arylcycloalkylamine
+c1ccc([C@@]2(N3CCCCC3)CC[C@@H]3C[C@@H]32)cc1	C17H23N	arylcycloalkylamine
+c1ccc([C@@]2(N3CCCCC3)CC[C@H]3C[C@H]32)cc1	C17H23N	arylcycloalkylamine
+c1ccc([C@]2(N3CCCCC3)CC[C@H]3C[C@H]32)cc1	C17H23N	arylcycloalkylamine
+COc1ccccc1C1(N)CCCCC1	C13H19NO	arylcycloalkylamine
+NC1(c2ccc3c(c2)OCO3)CCCCC1	C13H17NO2	arylcycloalkylamine
+NC1(c2ccc3c(c2)OCCO3)CCCCC1	C14H19NO2	arylcycloalkylamine
+CCOc1cccc(C2(N)CCCCC2)c1	C14H21NO	arylcycloalkylamine
+NC1(c2ccc3c(c2)CCO3)CCCCC1	C14H19NO	arylcycloalkylamine
+COc1cc(OC)cc(C2(N)CCCCC2)c1	C14H21NO2	arylcycloalkylamine
+COc1ccc(C2(N)CCCCC2)cc1C	C14H21NO	arylcycloalkylamine
+Cc1cc(C2(N)CCCCC2)ccc1F	C13H18FN	arylcycloalkylamine
+NC1(c2cccc(F)c2)CCCCC1	C12H16FN	arylcycloalkylamine
+c1cc2c(cc1C1(N3CCCCC3)CCCCC1)OCO2	C18H25NO2	arylcycloalkylamine
+CC(C)Oc1cccc(C2(N3CCCCC3)CCCCC2)c1	C20H31NO	arylcycloalkylamine
+c1cc2c(cc1C1(N3CCCCC3)CCCCC1)CCO2	C19H27NO	arylcycloalkylamine
+COc1ccc(C2(N3CCCCC3)CCCCC2)cc1C	C19H29NO	arylcycloalkylamine
+Cc1cc(C2(N3CCCCC3)CCCCC2)ccc1F	C18H26FN	arylcycloalkylamine
+FC(F)(F)Oc1cccc(C2(N3CCCCC3)CCCCC2)c1	C18H24F3NO	arylcycloalkylamine
+COc1ccc(C2(N3CCCCC3)CCCCC2)cc1OC	C19H29NO2	arylcycloalkylamine
+COc1cc(OC)cc(C2(N3CCCCC3)CCCCC2)c1	C19H29NO2	arylcycloalkylamine
+COc1ccc(OC)c(C2(N3CCCCC3)CCCCC2)c1	C19H29NO2	arylcycloalkylamine
+COc1ccccc1C1(N2CCCC2)CCCCC1	C17H25NO	arylcycloalkylamine
+c1cc2c(cc1C1(N3CCCC3)CCCCC1)OCO2	C17H23NO2	arylcycloalkylamine
+CNC1(c2cccc(OC)c2)CCCCC1	C14H21NO	arylcycloalkylamine
+CCCNC1(c2cccc(C)c2)CCCCC1	C16H25N	arylcycloalkylamine
+CCCNC1(c2ccc3c(c2)OCO3)CCCCC1	C16H23NO2	arylcycloalkylamine
+NC1(c2cccs2)CC2CCC1C2	C11H15NS	arylcycloalkylamine
+COc1cccc(C2(N)CC3CCC2C3)c1	C14H19NO	arylcycloalkylamine
+COc1ccc(C2(N)CC3CCC2C3)cc1	C14H19NO	arylcycloalkylamine
+Cc1cccc(C2(N)CC3CCC2C3)c1	C14H19N	arylcycloalkylamine
+NC1(c2ccc3c(c2)OCO3)CC2CCC1C2	C14H17NO2	arylcycloalkylamine
+c1csc(C2(N3CCCCC3)CC3CCC2C3)c1	C16H23NS	arylcycloalkylamine
+COc1cccc(C2(N3CCCCC3)CC3CCC2C3)c1	C19H27NO	arylcycloalkylamine
+Cc1cccc(C2(N3CCCCC3)CC3CCC2C3)c1	C19H27N	arylcycloalkylamine
+c1cc2c(cc1C1(N3CCCCC3)CC3CCC1C3)OCO2	C19H25NO2	arylcycloalkylamine
+COc1cccc(C2(N3CCCC3)CC3CCC2C3)c1	C18H25NO	arylcycloalkylamine
+c1cc2c(cc1C1(N3CCCC3)CC3CCC1C3)OCO2	C18H23NO2	arylcycloalkylamine
+CCNC1(c2ccccc2)CC2CCC1C2	C15H21N	arylcycloalkylamine
+CCCNC1(c2ccccc2)CC2CCC1C2	C16H23N	arylcycloalkylamine
+CCNC1(c2cccc(OC)c2)CC2CCC1C2	C16H23NO	arylcycloalkylamine
+CCCNC1(c2cccc(OC)c2)CC2CCC1C2	C17H25NO	arylcycloalkylamine
+CCNC1(c2cccc(C)c2)CC2CCC1C2	C16H23N	arylcycloalkylamine
+CCCNC1(c2cccc(C)c2)CC2CCC1C2	C17H25N	arylcycloalkylamine
+c1csc(C2(N3CCCC3)CC3CCC2C3)c1	C15H21NS	arylcycloalkylamine
+COc1cc(CC#N)cc(OC)c1O	C10H11NO3	unknown
+CC1N=CONC1c1ccc(F)cc1	C10H11FN2O	unknown
+CN(C(=O)Cc1ccc(Cl)c(Cl)c1)[C@H]1CC[C@@]2(CCCO2)C[C@@H]1N1CCCC1	C22H30Cl2N2O2	unknown
+NC1(c2ccccc2Cl)CCCCC1=O	C12H14ClNO	arylcycloalkylamine
+COc1cc(SC)c(OC)cc1C=O	C10H12O3S	unknown
+CCSc1cc(OC)c(C=O)cc1OC	C11H14O3S	unknown
+CCCSc1cc(OC)c(C=O)cc1OC	C12H16O3S	unknown
+CCCCSc1cc(OC)c(C=O)cc1OC	C13H18O3S	unknown
+CCCCCSc1cc(OC)c(C=O)cc1OC	C14H20O3S	unknown
+COc1cc(SC(C)C)c(OC)cc1C=O	C12H16O3S	unknown
+COc1cc(SC)c(OC)cc1/C=C(\C)[N+](=O)[O-]	C12H15NO4S	unknown
+CCSc1cc(OC)c(/C=C(\C)[N+](=O)[O-])cc1OC	C13H17NO4S	unknown
+CCCSc1cc(OC)c(/C=C(\C)[N+](=O)[O-])cc1OC	C14H19NO4S	unknown
+CCCCSc1cc(OC)c(/C=C(\C)[N+](=O)[O-])cc1OC	C15H21NO4S	unknown
+CCCCCSc1cc(OC)c(/C=C(\C)[N+](=O)[O-])cc1OC	C16H23NO4S	unknown
+COc1cc(SC(C)C)c(OC)cc1/C=C(\C)[N+](=O)[O-]	C14H19NO4S	unknown
+COc1cc(SCCc2ccccc2)c(OC)cc1C=O	C17H18O3S	unknown
+COc1cc(SCCc2ccccc2)c(OC)cc1/C=C(\C)[N+](=O)[O-]	C19H21NO4S	unknown
+CCCCCn1cc(C(=S)c2cccc3ccccc23)c2ccccc21	C24H23NS	cannabinoid
+CCCCCn1cc(S(=O)(=O)c2cccc3ccccc23)c2ccccc21	C23H23NO2S	cannabinoid
+CCN(CC)CCCOc1ccc(C#N)cc1	C14H20N2O	unknown
+CCOc1cc(/C=C/[N+](=O)[O-])cc(OC)c1OC	C12H15NO5	unknown
+COc1cc(SC)c(OC)cc1/C=C/[N+](=O)[O-]	C11H13NO4S	unknown
+O=C(c1ccc(F)cc1)C1CCN(CCn2c(=O)[nH]c3ccccc3c2=O)CC1	C22H22FN3O3	unknown
+CC(N)Cc1cn(C)c2ccc3c(c12)CCCO3	C15H20N2O	tryptamine
+C[C@H](N)Cn1ncc2ccc(O)c(F)c21	C10H12FN3O	unknown
+Cc1c(O)ccc2cnn(C[C@H](C)N)c12	C11H15N3O	unknown
+CC(N)Cn1ncc2ccc(O)c(I)c21	C10H12IN3O	unknown
+NCCn1ncc2ccc(O)cc21	C9H11N3O	unknown
+Cc1nc2sccn2c(=O)c1CCN1CCC(=C(c2ccc(F)cc2)c2ccc(F)cc2)CC1	C27H25F2N3OS	unknown
+CN1C[C@H](C(=O)NC(C)(C)C)C=C2c3cccc4[nH]cc(c34)C[C@]21C	C21H27N3O	unknown
+CC(NC(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@@]2(C)N(C)C1)c1ccccc1	C25H27N3O	unknown
+CCC(C)N(C)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@@]2(C)N(C)C1	C22H29N3O	unknown
+CCC(C)N(CC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@@]2(C)N(C)C1	C23H31N3O	unknown
+CC1CCCC(C)N1C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@@]2(C)N(C)C1	C24H31N3O	unknown
+CNCCc1cc(OC)c(I)cc1OC	C11H16INO2	unknown
+CCCNCCc1cc(OC)c(I)cc1OC	C13H20INO2	unknown
+COc1cc(CCNCc2cccc3c2OCC3)c(OC)cc1I	C19H22INO3	unknown
+CN(C)CCc1c2n(c3ccccc13)C(c1cc(O)c(O)c(O)c1)C(O)C2c1ccc(O)cc1O	C27H28N2O6	unknown
+COc1ccc(C(O)CNC(=O)/C=C/c2ccccc2)cc1	C18H19NO3	unknown
+CC(C)NCC(O)c1ccc(O)cc1	C11H17NO2	unknown
+CCN(CC)CCc1ccccc1	C12H19N	unknown
+CCN(N=O)C(C)Cc1cccc(C(F)(F)F)c1	C12H15F3N2O	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3C(O)(C[C@H]2N(C)C1)C(=O)N4	C20H25N3O3	unknown
+Clc1ccc2c(c1)C(N1CCNCC1)=Nc1ccccc1O2	C17H16ClN3O	unknown
+CCN1CCCC1CNC(=O)c1cc(S(=O)(=O)CC)c(N)cc1OC	C17H27N3O4S	unknown
+CN(C)CCC=C1c2ccccc2CCc2ccccc21	C20H23N	unknown
+C[N+](C)([O-])CCC=C1c2ccccc2CCc2ccccc21	C20H23NO	unknown
+CNCCC=C1c2ccccc2CCc2ccccc21	C19H21N	unknown
+CN(C)CCCN1c2ccccc2CCc2ccc(Cl)cc21	C19H23ClN2	unknown
+CNCCCN1c2ccccc2CCc2ccc(Cl)cc21	C18H21ClN2	unknown
+CN1CCN(C2=Nc3cc(Cl)ccc3Nc3ccccc32)CC1	C18H19ClN4	unknown
+Clc1ccc2c(c1)N=C(N1CCNCC1)c1ccccc1N2	C17H17ClN4	unknown
+CN(C)CCC=C1c2ccccc2C=Cc2ccccc21	C20H21N	unknown
+CN(C)CCN1C(=O)c2ccccc2N(C)c2ccccc21	C18H21N3O	unknown
+CN(C)CC/C=C1\c2ccccc2CSc2ccccc21	C19H21NS	unknown
+CN(C)CC/C=C1\c2ccccc2COc2ccccc21	C19H21NO	unknown
+CNCC/C=C1\c2ccccc2COc2ccccc21	C18H19NO	unknown
+OCCN1CCN(CCCN2c3ccccc3Sc3ccc(C(F)(F)F)cc32)CC1	C22H26F3N3OS	unknown
+OCCN1CCN(CC/C=C2/c3ccccc3Sc3ccc(C(F)(F)F)cc32)CC1	C23H25F3N2OS	unknown
+O=C(CCCN1CCC(O)(c2ccc(Cl)cc2)CC1)c1ccc(F)cc1	C21H23ClFNO2	unknown
+OCCOCCN1CCN(C(c2ccccc2)c2ccc(Cl)cc2)CC1	C21H27ClN2O2	unknown
+CNCCCN1c2ccccc2CCc2ccccc21	C18H22N2	unknown
+COc1ccc2c(c1)N(C[C@H](C)CN(C)C)c1ccccc1S2	C19H24N2OS	unknown
+CNCCCC12CCC(c3ccccc31)c1ccccc12	C20H23N	unknown
+O=C(CCCN1CCC(n2c(=O)[nH]c3ccccc32)CC1)c1ccc(F)cc1	C22H24FN3O2	unknown
+CC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	C16H22FNO	unknown
+CN1CCN2c3ccccc3Cc3ccccc3C2C1	C18H20N2	unknown
+CN1CCN2c3ncccc3Cc3ccccc3C2C1	C17H19N3	unknown
+O=C(NCCN1CCOCC1)c1ccc(Cl)cc1	C13H17ClN2O2	unknown
+Cc1ccc(C2(O)CCN(CCCC(=O)c3ccc(F)cc3)CC2)cc1	C22H26FNO2	unknown
+Cc1cc2c(s1)Nc1ccccc1N=C2N1CCN(C)CC1	C17H20N4S	unknown
+OCCN1CCN(CCCN2c3ccccc3C=Cc3ccccc32)CC1	C23H29N3O	unknown
+CN1CCN(CCCN2c3ccccc3Sc3ccccc32)CC1	C20H25N3S	unknown
+OCCN1CCN(CCCN2c3ccccc3Sc3ccc(Cl)cc32)CC1	C21H26ClN3OS	unknown
+O=c1[nH]c2ccccc2n1C1CCN(CCCC(c2ccc(F)cc2)c2ccc(F)cc2)CC1	C28H29F2N3O	unknown
+CC(CN1c2ccccc2Sc2ccccc21)N(C)C	C17H20N2S	unknown
+CN(C)CCCN1c2ccccc2Sc2cccnc21	C16H19N3S	unknown
+CCOc1ccccc1OC(c1ccccc1)C1CNCCO1	C19H23NO3	unknown
+CSc1ccc2c(c1)N(CCC1CCCCN1C)c1ccccc1S2	C21H26N2S2	unknown
+CCOC(=O)[C@@]1(c2ccccc2)CCC=C[C@@H]1NC	C16H21NO2	unknown
+O=c1n(CCCN2CCN(c3cccc(Cl)c3)CC2)nc2ccccn12	C19H22ClN5O	unknown
+CC(CN(C)C)CN1c2ccccc2CCc2ccccc21	C20H26N2	unknown
+O=C1Cc2cc(CCN3CCN(c4nsc5ccccc45)CC3)c(Cl)cc2N1	C21H21ClN4OS	unknown
+CN(C)CCOC1=Cc2ccccc2Sc2ccc(Cl)cc21	C18H18ClNOS	unknown
+OCCN1CCN(CC/C=C2/c3ccccc3Sc3ccc(Cl)cc32)CC1	C22H25ClN2OS	unknown
+CN(C)CCc1c[nH]c2cccc(OC3OC(C(=O)O)C(O)C(O)C3O)c12	C18H24N2O7	tryptamine
+CC(C)[C@H]1C(=O)N2CCC[C@H]2[C@]2(O)O[C@@](C)(NC(=O)[C@@H]3C=C4c5cccc6[nH]cc(c56)C[C@H]4N(C)C3)C(=O)N12	C29H35N5O5	unknown
+CCNCC(C)(C)CCC(=O)c1ccc(N)cc1	C15H24N2O	unknown
+NCCCNCCc1c[nH]c2ccccc12	C13H19N3	tryptamine
+CN(C)CCCNCCc1c[nH]c2ccccc12	C15H23N3	tryptamine
+CC(=O)O[C@H]1C=C[C@H]2[C@H]3Cc4ccc(O)c5c4[C@@]2(CCN3C)[C@H]1O5	C19H21NO4	unknown
+COc1ccc2c(c1OC)C(=O)O[C@@H]2[C@H]1c2c(cc3c(c2OC)OCO3)CCN1C	C22H23NO7	unknown
+COc1ccc(Cc2nccc3cc(OC)c(OC)cc23)cc1OC	C20H21NO4	unknown
+Oc1ccc(CC2NCCc3cc(O)c(O)cc32)cc1	C16H17NO3	unknown
+Oc1cc2c(cc1O)C(Cc1ccc(O)c(Cl)c1)NCC2	C16H16ClNO3	unknown
+Oc1cc2c(cc1O)C(Cc1ccc(O)c(Br)c1)NCC2	C16H16BrNO3	unknown
+Oc1cc2c(cc1O)C(Cc1ccc(O)c(I)c1)NCC2	C16H16INO3	unknown
+O=[N+]([O-])/C=C/c1ccc(O)c(Cl)c1	C8H6ClNO3	unknown
+O=[N+]([O-])/C=C/c1ccc(O)c(Br)c1	C8H6BrNO3	unknown
+COc1ccc(CCN)cc1Cl	C9H12ClNO	unknown
+COc1ccc(CCN)cc1Br	C9H12BrNO	unknown
+O=C(c1cccc2ccccc12)n1c(-c2ccccn2)nc2ccccc21	C23H15N3O	cannabinoid
+O=C(c1cccc2ccccc12)n1c(-c2ccccn2)nc2cc(F)ccc21	C23H14FN3O	cannabinoid
+O=C(c1cccc2ccccc12)n1c(-c2ccccn2)nc2ccc(F)cc21	C23H14FN3O	cannabinoid
+Cc1cc2nc(-c3ccccn3)n(C(=O)c3cccc4ccccc34)c2cc1C	C25H19N3O	cannabinoid
+O=C(c1cccc2ccccc12)n1c(-c2cccnc2)nc2ccccc21	C23H15N3O	cannabinoid
+O=C(c1cccc2ccccc12)n1c(-c2cccnc2)nc2cc(F)ccc21	C23H14FN3O	cannabinoid
+O=C(c1cccc2ccccc12)n1c(-c2cccnc2)nc2ccc(F)cc21	C23H14FN3O	cannabinoid
+Cc1cc2nc(-c3cccnc3)n(C(=O)c3cccc4ccccc34)c2cc1C	C25H19N3O	cannabinoid
+O=C(c1cccc2ccccc12)n1c(-c2ccncc2)nc2cc(F)ccc21	C23H14FN3O	cannabinoid
+O=C(c1cccc2ccccc12)n1c(-c2ccncc2)nc2ccc(F)cc21	C23H14FN3O	cannabinoid
+Cc1cc2nc(-c3ccncc3)n(C(=O)c3cccc4ccccc34)c2cc1C	C25H19N3O	cannabinoid
+O=C(c1ccc2ccccc2c1)n1c(-c2ccccn2)nc2ccccc21	C23H15N3O	cannabinoid
+O=C(c1ccc2ccccc2c1)n1c(-c2ccccn2)nc2ccc(F)cc21	C23H14FN3O	cannabinoid
+Cc1cc2nc(-c3ccccn3)n(C(=O)c3ccc4ccccc4c3)c2cc1C	C25H19N3O	cannabinoid
+O=C(c1ccc2ccccc2c1)n1c(-c2cccnc2)nc2ccccc21	C23H15N3O	cannabinoid
+O=C(c1ccc2ccccc2c1)n1c(-c2cccnc2)nc2cc(F)ccc21	C23H14FN3O	cannabinoid
+O=C(c1ccc2ccccc2c1)n1c(-c2cccnc2)nc2ccc(F)cc21	C23H14FN3O	cannabinoid
+Cc1cc2nc(-c3cccnc3)n(C(=O)c3ccc4ccccc4c3)c2cc1C	C25H19N3O	cannabinoid
+O=C(c1ccc2ccccc2c1)n1c(-c2ccncc2)nc2ccccc21	C23H15N3O	cannabinoid
+O=C(c1ccc2ccccc2c1)n1c(-c2ccncc2)nc2cc(F)ccc21	C23H14FN3O	cannabinoid
+O=C(c1ccc2ccccc2c1)n1c(-c2ccncc2)nc2ccc(F)cc21	C23H14FN3O	cannabinoid
+Cc1cc2nc(-c3ccncc3)n(C(=O)c3ccc4ccccc4c3)c2cc1C	C25H19N3O	cannabinoid
+c1ccc(-c2nc3ccccc3n2Cc2cccc3ccccc23)nc1	C23H17N3	cannabinoid
+Fc1ccc2c(c1)nc(-c1ccccn1)n2Cc1cccc2ccccc12	C23H16FN3	cannabinoid
+Cc1cc2nc(-c3ccccn3)n(Cc3cccc4ccccc34)c2cc1C	C25H21N3	cannabinoid
+c1cncc(-c2nc3ccccc3n2Cc2cccc3ccccc23)c1	C23H17N3	cannabinoid
+Fc1ccc2c(c1)nc(-c1cccnc1)n2Cc1cccc2ccccc12	C23H16FN3	cannabinoid
+Fc1ccc2nc(-c3cccnc3)n(Cc3cccc4ccccc34)c2c1	C23H16FN3	cannabinoid
+Cc1cc2nc(-c3cccnc3)n(Cc3cccc4ccccc34)c2cc1C	C25H21N3	cannabinoid
+c1ccc2c(Cn3c(-c4ccncc4)nc4ccccc43)cccc2c1	C23H17N3	cannabinoid
+Fc1ccc2c(c1)nc(-c1ccncc1)n2Cc1cccc2ccccc12	C23H16FN3	cannabinoid
+Fc1ccc2nc(-c3ccncc3)n(Cc3cccc4ccccc34)c2c1	C23H16FN3	cannabinoid
+Cc1cc2nc(-c3ccncc3)n(Cc3cccc4ccccc34)c2cc1C	C25H21N3	cannabinoid
+c1ccc(-c2nc3ccccc3n2Cc2ccc3ccccc3c2)nc1	C23H17N3	cannabinoid
+Fc1ccc2c(c1)nc(-c1ccccn1)n2Cc1ccc2ccccc2c1	C23H16FN3	cannabinoid
+Fc1ccc2nc(-c3ccccn3)n(Cc3ccc4ccccc4c3)c2c1	C23H16FN3	cannabinoid
+Cc1cc2nc(-c3ccccn3)n(Cc3ccc4ccccc4c3)c2cc1C	C25H21N3	cannabinoid
+c1cncc(-c2nc3ccccc3n2Cc2ccc3ccccc3c2)c1	C23H17N3	cannabinoid
+Fc1ccc2c(c1)nc(-c1cccnc1)n2Cc1ccc2ccccc2c1	C23H16FN3	cannabinoid
+Fc1ccc2nc(-c3cccnc3)n(Cc3ccc4ccccc4c3)c2c1	C23H16FN3	cannabinoid
+Cc1cc2nc(-c3cccnc3)n(Cc3ccc4ccccc4c3)c2cc1C	C25H21N3	cannabinoid
+c1ccc2cc(Cn3c(-c4ccncc4)nc4ccccc43)ccc2c1	C23H17N3	cannabinoid
+Fc1ccc2c(c1)nc(-c1ccncc1)n2Cc1ccc2ccccc2c1	C23H16FN3	cannabinoid
+Fc1ccc2nc(-c3ccncc3)n(Cc3ccc4ccccc4c3)c2c1	C23H16FN3	cannabinoid
+Cc1cc2nc(-c3ccncc3)n(Cc3ccc4ccccc4c3)c2cc1C	C25H21N3	cannabinoid
+O=C1CCc2ccc(OCCCCN3CCN(c4cccc(Cl)c4Cl)CC3)cc2N1	C23H27Cl2N3O2	unknown
+CN1C2CCC1CC(OC(=O)C(CO)c1ccccc1)C2	C17H23NO3	unknown
+O=C(CCCN1CCC(O)(c2ccc(Br)cc2)CC1)c1ccc(F)cc1	C21H23BrFNO2	unknown
+O=C1CC2(CCCC2)CC(=O)N1CCCCN1CCN(c2ncccn2)CC1	C21H31N5O2	unknown
+CN(C)CC/C=C1/c2ccccc2Sc2ccc(Cl)cc21	C18H18ClNS	unknown
+O=C(CCCN1CC=C(n2c(=O)[nH]c3ccccc32)CC1)c1ccc(F)cc1	C22H22FN3O2	unknown
+O=C1NCN(c2ccccc2)C12CCN(CCCC(c1ccc(F)cc1)c1ccc(F)cc1)CC2	C29H31F2N3O	unknown
+COCCCC/C(=N\OCCN)c1ccc(C(F)(F)F)cc1	C15H21F3N2O2	unknown
+NC(=O)C1(N2CCCCC2)CCN(CCCC(=O)c2ccc(F)cc2)CC1	C21H30FN3O2	unknown
+Cc1nc2n(c(=O)c1CCN1CCC(c3noc4cc(F)ccc34)CC1)CCCC2	C23H27FN4O2	unknown
+CN1C2CC(OC(=O)[C@H](CO)c3ccccc3)CC1C1OC12	C17H21NO4	unknown
+O=C1NCCN1CCN1CCC(c2cn(-c3ccc(F)cc3)c3ccc(Cl)cc23)CC1	C24H26ClFN4O	unknown
+CCCc1nn(C)c2c(=O)nc(-c3cc(S(=O)(=O)N4CCN(C)CC4)ccc3OCC)[nH]c12	C22H30N6O4S	unknown
+CCN1CCCC1CNC(=O)c1cc(S(N)(=O)=O)ccc1OC	C15H23N3O4S	unknown
+CN1CC(=O)N2[C@H](c3ccc4c(c3)OCO4)c3[nH]c4ccccc4c3C[C@@H]2C1=O	C22H19N3O4	unknown
+CCCc1nc(C)c2c(=O)[nH]c(-c3cc(S(=O)(=O)N4CCN(CC)CC4)ccc3OCC)nn12	C23H32N6O4S	unknown
+CCN(C(C)=O)c1cccc(-c2ccnc3c(C#N)cnn23)c1	C17H15N5O	unknown
+NCCc1c[nH]c2cc3c(cc12)OCCC3	C13H16N2O	tryptamine
+COc1ccc2cccc(N3CCNCC3)c2c1	C15H18N2O	unknown
+CN1C[C@H](C(=O)N2CCCCCC2)C=C2c3cccc4[nH]cc(c34)C[C@H]21	C22H27N3O	unknown
+CCCC1(N2CCCCC2)CCCCC1	C14H27N	arylcycloalkylamine
+CCC1(N2CCCCC2)CCCCC1	C13H25N	arylcycloalkylamine
+CCCCC1(N2CCCCC2)CCCCC1	C15H29N	arylcycloalkylamine
+CCCCCCCCC1(N2CCCCC2)CCCCC1	C19H37N	arylcycloalkylamine
+C#CC1(N2CCCCC2)CCCCC1	C13H21N	arylcycloalkylamine
+CC#CC1(N2CCCCC2)CCCCC1	C14H23N	arylcycloalkylamine
+CSc1ccc(C2(N3CCCCC3)CCCCC2)cc1	C18H27NS	arylcycloalkylamine
+C[N+]1(C2(c3ccccc3)CCCCC2)CCCCC1	C18H28N	arylcycloalkylamine
+OC1CCN(C2(c3ccccc3)CCCCC2)CC1	C17H25NO	arylcycloalkylamine
+CC1(C)CCN(C2(c3ccccc3)CCCCC2)CC1	C19H29N	arylcycloalkylamine
+c1ccc(C2(N3CCCCC3)CCSCC2)cc1	C16H23NS	arylcycloalkylamine
+c1ccc(C2(N3CCCCC3)CCC2)cc1	C15H21N	arylcycloalkylamine
+CN1CCC(c2ccccc2)(N2CCCCC2)CC1	C17H26N2	arylcycloalkylamine
+c1ccc(C2(N3CCCCC3)C3CC4CC(C3)CC2C4)cc1	C21H29N	arylcycloalkylamine
+COC1CCCCC1(c1ccccc1)N1CCCCC1	C18H27NO	arylcycloalkylamine
+CC1CCCC(c2ccccc2)(N2CCCCC2)C1	C18H27N	arylcycloalkylamine
+CC1(C)CCC(c2ccccc2)(N2CCCCC2)CC1	C19H29N	arylcycloalkylamine
+CC1CC(C)(C)CC(c2ccccc2)(N2CCCCC2)C1	C20H31N	arylcycloalkylamine
+CC(C)(C)C1CCC(c2ccccc2)(N2CCCCC2)CC1	C21H33N	arylcycloalkylamine
+OC1CCC(c2ccccc2)(N2CCCCC2)CC1	C17H25NO	arylcycloalkylamine
+CCCCCn1cc(C2=[O+]C(C)(C)C(C)(C)C2)c2ccccc21	C21H30NO	unknown
+CCCCCn1cc(C2=CC(C)(C)C(C)(C)O2)c2ccccc21	C21H29NO	unknown
+C=C(C)C(C)(C)CC(=O)c1cn(CCCCC)c2ccccc12	C21H29NO	cannabinoid
+CNC(C)C(=O)c1ccc(CO)cc1	C11H15NO2	beta-ketone
+CC(N)C(=O)c1ccc(CO)cc1	C10H13NO2	beta-ketone
+CNC(C)C(=O)c1ccc(C(=O)O)cc1	C11H13NO3	beta-ketone
+CNC(C)C(O)c1ccc(C(=O)O)cc1	C11H15NO3	unknown
+CNC(C)CC1=CC(=O)C(O)=CC1=O	C10H13NO3	unknown
+CNC(C)CC1=CC(=O)C(=O)C=C1	C10H13NO2	unknown
+CNC(C)Cc1c(O)cc(O)c(O)c1SCC(NC(C)=O)C(=O)O	C15H22N2O6S	unknown
+CC(C)=NCCc1ccccc1	C11H15N	unknown
+COc1cc(CCN=C(C)C)c(OC)cc1I	C13H18INO2	unknown
+CCc1cc(OC)c(CCN=C(C)C)cc1OC	C15H23NO2	unknown
+COc1cc(CCN=C(C)C)c(OC)cc1Cl	C13H18ClNO2	unknown
+CCSc1cc(OC)c(CCN=C(C)C)cc1OC	C15H23NO2S	unknown
+CCCSc1cc(OC)c(CCN=C(C)C)cc1OC	C16H25NO2S	unknown
+COc1cc(CCN=C(C)C)c(OC)cc1Br	C13H18BrNO2	unknown
+CC(C)=NC(C)Cc1ccccc1	C12H17N	unknown
+COc1ccc(CC(C)N=C(C)C)cc1	C13H19NO	unknown
+CC(C)=NC(C)Cc1ccc2c(c1)OCO2	C13H17NO2	unknown
+COc1ccc(OC)c(CC(C)N=C(C)C)c1	C14H21NO2	unknown
+CC(C)=NCCc1c[nH]c2ccccc12	C13H16N2	tryptamine
+CC(C)=NC(C)Cc1c[nH]c2ccccc12	C14H18N2	tryptamine
+CCC(Cc1c[nH]c2ccc(OC)cc12)N=C(C)C	C16H22N2O	tryptamine
+CCC(Cc1ccccc1)N(C)C	C12H19N	unknown
+CC[C@@H]1CN2CCc3c([nH]c4cccc(OC)c34)C2=C2OC(=O)C(C=O)=C21	C21H20N2O4	unknown
+CCc1c(C(=O)OC)c(C=O)c2n(c1=O)CCc1c-2[nH]c2cccc(OC)c12	C21H20N2O5	unknown
+COC(=O)C1=CO[C@@H](C)[C@H]2CN3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]12	C21H24N2O3	unknown
+COC(=O)C1=CO[C@@H](C)[C@H]2CN3CC[C@]4(C(=O)Nc5ccccc54)[C@@H]3C[C@H]12	C21H24N2O4	unknown
+CC[C@H]1CN2CC[C@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC	C22H28N2O4	unknown
+CC[C@@H]1CN2CC[C@]3(Nc4cccc(OC)c4C3=O)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC	C23H30N2O5	unknown
+CC(C)C[C@H]1C(=O)N2CCC[C@H]2[C@]2(O)O[C@](NC(=O)[C@@H]3C=C4c5cccc6[nH]c(Br)c(c56)C[C@H]4N(C)C3)(C(C)C)C(=O)N12	C32H40BrN5O5	unknown
+CCCN1C[C@H](CSC)C[C@@H]2c3cccc4[nH]cc(c34)C[C@H]21	C19H26N2S	unknown
+C=CCN1C[C@H](C(=O)N(CCCN(C)C)C(=O)NCC)C[C@@H]2c3cccc4[nH]cc(c34)C[C@H]21	C26H37N5O2	unknown
+CN[C@@H]1Cc2c[nH]c3cccc(c23)[C@H]1/C=C(\C)C=O	C16H18N2O	unknown
+C[C@H]1CN(C)[C@@H]2Cc3c[nH]c4cccc(c34)[C@H]2[C@H]1O	C16H20N2O	unknown
+CC(=O)O[C@@H]1[C@@H]2c3cccc4[nH]cc(c34)C[C@H]2N(C)C[C@@H]1C	C18H22N2O2	unknown
+C=CC(C)(C)c1[nH]c2cccc3c2c1C[C@@H]1[C@@H]3[C@@H](OC(C)=O)[C@@H](C)CN1C	C23H30N2O2	unknown
+C=CC(C)(C)c1[nH]c2cccc3c2c1C[C@@H]1[C@@H]3C=C(C(=O)O)CN1C	C21H24N2O2	unknown
+CCCC(C(=O)c1ccc2c(c1)C1OC1C=C2)N1CCCC1	C19H23NO2	unknown
+CN(C)CCCN1c2ccccc2Sc2ccccc21	C17H20N2S	unknown
+COc1ccc(F)cc1C1CC1CNC1CC1	C14H18FNO	unknown
+COc1ccc(F)cc1C1CC1CNCC1CC1	C15H20FNO	unknown
+COc1ccc(F)cc1C1CC1CNCC1CCCCC1	C18H26FNO	unknown
+COc1ccccc1CNCC1CC1c1cc(F)ccc1OC	C19H22FNO2	unknown
+COc1cccc(CNCC2CC2c2cc(F)ccc2OC)c1	C19H22FNO2	unknown
+COc1ccc(CNCC2CC2c2cc(F)ccc2OC)cc1	C19H22FNO2	unknown
+COc1ccc(F)cc1C1CC1CNCc1ccccc1O	C18H20FNO2	unknown
+COc1ccc(F)cc1C1CC1CNCc1ccccc1OCCF	C20H23F2NO2	unknown
+COc1ccc(F)cc1C1CC1CNCc1ccccc1C#N	C19H19FN2O	unknown
+COc1ccc(F)cc1C1CC1CNCc1ccccc1C(N)=O	C19H21FN2O2	unknown
+COc1ccc(F)cc1C1CC1CNCc1ccccc1F	C18H19F2NO	unknown
+COc1ccc(F)cc1C1CC1CNCc1ccccc1Cl	C18H19ClFNO	unknown
+COc1ccccc1CN(C)CC1CC1c1cc(F)ccc1OC	C20H24FNO2	unknown
+COc1ccccc1C(C)NCC1CC1c1cc(F)ccc1OC	C20H24FNO2	unknown
+COc1ccc(F)cc1C1CC1CNC1(c2ccccc2OC)CC1	C21H24FNO2	unknown
+COc1ccccc1CCNCC1CC1c1cc(F)ccc1OC	C20H24FNO2	unknown
+COc1ccc(F)cc1C1CC1CNCc1cccs1	C16H18FNOS	unknown
+COc1ccc(F)cc1C1CC1CNCc1sccc1OC	C17H20FNO2S	unknown
+COc1cscc1CNCC1CC1c1cc(F)ccc1OC	C17H20FNO2S	unknown
+COc1ccc(F)cc1C1CC1CNCc1ccsc1OC	C17H20FNO2S	unknown
+COc1ccc(F)cc1C1CC1CNCc1cccnc1OC	C18H21FN2O2	unknown
+COc1ccc(F)cc1C1CC1CNCc1cccc2ccsc12	C20H20FNOS	unknown
+COc1ccc(F)cc1C1CC1CNCc1cccc2cc[nH]c12	C20H21FN2O	unknown
+COc1ccc(F)cc1C1CC1CNCc1cccc2cccnc12	C21H21FN2O	unknown
+C=CCOc1ccc(F)cc1C1CC1CNCc1ccccc1OC	C21H24FNO2	unknown
+COc1ccccc1CNCC1CC1c1cc(F)ccc1OCCF	C20H23F2NO2	unknown
+C=CCOc1ccc(Cl)cc1C1CC1CN	C13H16ClNO	unknown
+NCC1CC1c1cc(Cl)ccc1OCCF	C12H15ClFNO	unknown
+COc1ccc2c(c1C1CC1CN)CCO2	C13H17NO2	unknown
+CCOc1ccc2c(c1C1CC1CN)CCO2	C14H19NO2	unknown
+CCCOc1ccc2c(c1C1CC1CN)CCO2	C15H21NO2	unknown
+C=CCOc1ccc2c(c1C1CC1CN)CCO2	C15H19NO2	unknown
+NCC1CC1c1c(OCC2CC2)ccc2c1CCO2	C16H21NO2	unknown
+NCC1CC1c1c(OCCF)ccc2c1CCO2	C14H18FNO2	unknown
+COc1ccc2occc2c1C1CC1CN	C13H15NO2	unknown
+CCOc1ccc2occc2c1C1CC1CN	C14H17NO2	unknown
+CCCOc1ccc2occc2c1C1CC1CN	C15H19NO2	unknown
+C=CCOc1ccc2occc2c1C1CC1CN	C15H17NO2	unknown
+NCC1CC1c1c(OCCF)ccc2occc12	C14H16FNO2	unknown
+NCC1CC1c1c(OCC2CC2)ccc2occc12	C16H19NO2	unknown
+CC(C)Oc1ccc2occc2c1C1CC1CN	C15H19NO2	unknown
+C=C(F)COc1ccc2occc2c1C1CC1CN	C15H16FNO2	unknown
+C=C(C)COc1ccc2occc2c1C1CC1CN	C16H19NO2	unknown
+CCc1cc2c(C3CC3CN)c(OC)ccc2o1	C15H19NO2	unknown
+CCOc1ccc2oc(CC)cc2c1C1CC1CN	C16H21NO2	unknown
+CCCOc1ccc2oc(CC)cc2c1C1CC1CN	C17H23NO2	unknown
+CCc1cc2c(C3CC3CN)c(OCCF)ccc2o1	C16H20FNO2	unknown
+C=CCOc1ccc2oc(CC)cc2c1C1CC1CN	C17H21NO2	unknown
+CCc1cc2c(C3CC3CN)c(OCC3CC3)ccc2o1	C18H23NO2	unknown
+Clc1cccc(COc2cncc(N3CCNCC3)n2)c1	C15H17ClN4O	unknown
+c1cc2c3c(c1)[C@H]1CCC[C@H]1CN3CCNC2	C15H20N2	unknown
+c1cc2c3c(c1)[C@H]1CCC[C@H]1N3CCNC2	C14H18N2	unknown
+Cc1cccc(C2CC2CN)c1	C11H15N	unknown
+NCC1CC1c1cc(F)ccc1OCC1CC1	C14H18FNO	unknown
+NCC1CC1c1cc(O)ccc1OCC1CC1	C14H19NO2	unknown
+NCC1CC1c1ccccc1OCC1CC1	C14H19NO	unknown
+C=CCOc1ccc(F)cc1C1CC1CN	C13H16FNO	unknown
+NCC1CC1c1cc(F)ccc1OCCF	C12H15F2NO	unknown
+CC(C)Oc1ccc(Cl)cc1C1CC1CN	C13H18ClNO	unknown
+CC1(C)Cc2cc(Cl)cc(C3CC3CN)c2O1	C14H18ClNO	unknown
+CCOc1ccc(Cl)cc1C1CC1CN	C12H16ClNO	unknown
+CCCOc1ccc(Cl)cc1C1CC1CN	C13H18ClNO	unknown
+CCCCOc1ccc(Cl)cc1C1CC1CN	C14H20ClNO	unknown
+NCC1CC1c1cc(Cl)ccc1OCC1CC1	C14H18ClNO	unknown
+COCCOc1ccc(Cl)cc1C1CC1CN	C13H18ClNO2	unknown
+CCCC(NC(C)CC)C(=O)c1ccccc1	C15H23NO	beta-ketone
+COc1ccc2c(c1OC)C(=O)OC2C1c2cc3c(cc2CCN1C)OCO3	C21H21NO6	unknown
+CN1CCc2cc3c(cc2C1O)OCO3	C11H13NO3	unknown
+CC1Cc2cc3c(cc2C(O)N1C)OCO3	C12H15NO3	unknown
+COC(=O)C(N)Cc1ccc(Cl)cc1	C10H12ClNO2	unknown
+CN(C)C/C=C(/c1ccc(Br)cc1)c1cccnc1	C16H17BrN2	unknown
+COc1ccccc1CNC(C)Cc1ccc(O)c(O)c1	C17H21NO3	unknown
+COc1ccccc1CN(C)C(C)Cc1ccc(C(=O)O)cc1	C19H23NO3	unknown
+COc1ccccc1CNC(C)Cc1ccc(C(=O)O)cc1	C18H21NO3	unknown
+CC(Cc1ccc(C(=O)O)cc1)NCc1ccccc1O	C17H19NO3	unknown
+C(=C/c1ccccc1)\CN1CCN(C(c2ccccc2)c2ccccc2)CC1	C26H28N2	unknown
+CNCC1CC1c1cc(F)ccc1OC	C12H16FNO	unknown
+C=CCOc1ccc(F)cc1C1CC1CNC	C14H18FNO	unknown
+CNCC1CC1c1cc(F)ccc1OCCF	C13H17F2NO	unknown
+CSCCOc1ccc(Cl)cc1C1CC1CN	C13H18ClNOS	unknown
+C#CCOc1ccc(Cl)cc1C1CC1CN	C13H14ClNO	unknown
+C=C(F)COc1ccc(Cl)cc1C1CC1CN	C13H15ClFNO	unknown
+C=C(C)COc1ccc(Cl)cc1C1CC1CN	C14H18ClNO	unknown
+NCC1CC1c1cc(Cl)ccc1OC(F)F	C11H12ClF2NO	unknown
+NCC1CC1c1cc(Cl)ccc1OCCCF	C13H17ClFNO	unknown
+CCCOc1ccc(F)cc1C1CC1CN	C13H18FNO	unknown
+C=C(F)COc1ccc(F)cc1C1CC1CN	C13H15F2NO	unknown
+NC(=O)CS(=O)Cc1ccccc1-c1ccc(Cl)cc1	C15H14ClNO2S	unknown
+NC(=O)CS(=O)Cc1ccccc1-c1ccco1	C13H13NO3S	unknown
+NC(=O)CS(=O)Cc1ccccc1-c1cccs1	C13H13NO2S2	unknown
+NC(=O)CS(=O)Cc1ccccc1-c1ccsc1	C13H13NO2S2	unknown
+NC(=O)CS(=O)Cc1ccccc1-c1cccnc1	C14H14N2O2S	unknown
+NC(=O)CS(=O)Cc1ccccc1-c1ccc(Cl)s1	C13H12ClNO2S2	unknown
+NC(=O)CS(=O)Cc1ccccc1-c1csc2ccccc12	C17H15NO2S2	unknown
+NC(=O)CS(=O)Cc1ccccc1-c1cc2ccccc2s1	C17H15NO2S2	unknown
+NC(=O)CS(=O)Cc1cccc(-c2cc3ccccc3s2)c1	C17H15NO2S2	unknown
+NC(=O)CS(=O)Cc1ccccc1C1=CCCC1	C14H17NO2S	unknown
+NC(=O)CS(=O)Cc1ccccc1C1=CCCCC1	C15H19NO2S	unknown
+NC(=O)CS(=O)Cc1ccccc1C1=CCCCCC1	C16H21NO2S	unknown
+CCCc1nn(C)c2c(=O)[nH]c(-c3cc(C(=O)CN4CCN(CC)CC4)ccc3OCC)nc12	C25H34N6O3	unknown
+CCCOc1ccc(S(=O)(=O)N2CCN(CCO)CC2)cc1-c1nc2c(CCC)nn(C)c2c(=S)[nH]1	C24H34N6O4S2	unknown
+CC1(C)Oc2cc(C34CC5CC(CC(C5)C3)C4)cc(O)c2[C@@H]2CC(CO)CC[C@H]21	C26H36O3	cannabinoid
+Cc1c(C(N)=O)nn(-c2ccc(Cl)cc2Cl)c1-c1ccc(Cl)cc1	C17H12Cl3N3O	unknown
+O=C1CC[C@@]2(O)[C@H]3Cc4ccc(O)c5c4[C@@]2(CCN3CC2CC2)[C@H]1O5	C20H23NO4	unknown
+CCCN1CCc2cccc3c2C1Cc1ccc(O)c(O)c1-3	C19H21NO2	unknown
+CCCN1CCC(c2c[nH]c3cc(F)ccc23)CC1	C16H21FN2	unknown
+CCCN1CCC(c2cn(C)c3cc(F)ccc23)CC1	C17H23FN2	unknown
+CCCN1CCC(c2cn(C)c3ccc(F)cc23)CC1	C17H23FN2	unknown
+CCCN1CCC(c2csc3ccccc23)CC1	C16H21NS	unknown
+CCCN1CCC(c2coc3ccccc23)CC1	C16H21NO	unknown
+CCCN1CCC(c2noc3cc(F)ccc23)CC1	C15H19FN2O	unknown
+CCCN1CCC(c2n[nH]c3ccccc23)CC1	C15H21N3	unknown
+CCCN1CCC(n2ccc3ccccc32)CC1	C16H22N2	unknown
+CCCN1CCC(n2cnc3ccccc32)CC1	C15H21N3	unknown
+CCCN1CCC(n2c(=O)[nH]c3cc(Cl)ccc32)CC1	C15H20ClN3O	unknown
+CCCN1CCC(n2c(=O)n(C)c3cc(Cl)ccc32)CC1	C16H22ClN3O	unknown
+CCCN1CCC(N2C(=O)C(=O)c3ccccc32)CC1	C16H20N2O2	unknown
+CCCN1CCC(c2cccc3ccccc23)CC1	C18H23N	unknown
+CCCN1CCC(c2ccc3ccccc3c2)CC1	C18H23N	unknown
+CCCN1CCC(c2cc3ccccc3s2)CC1	C16H21NS	unknown
+CCCN1CCC(c2cccc(S(C)(=O)=O)c2)CC1	C15H23NO2S	unknown
+CCCN1CCCC(c2cccc(S(C)(=O)=O)c2)C1	C15H23NO2S	unknown
+CN1CC[C@]23c4c5ccc(O)c4O[C@H]2C(=O)CC[C@H]3[C@H]1C5	C17H19NO3	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3C(C[C@H]2N(C)C1)C(=O)N4	C20H25N3O2	unknown
+CCN(CCO)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C20H25N3O2	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cc(O)cc4[nH]cc(c34)C[C@H]2N(C)C1	C20H25N3O2	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3ccc(O)c4[nH]cc(c34)C[C@H]2N(C)C1	C20H25N3O2	unknown
+COc1ccc(CC(C)NCc2ccccc2O)cc1OC	C18H23NO3	unknown
+CC(Cc1ccc(O)c(O)c1)NCc1ccccc1O	C16H19NO3	unknown
+Cc1ccc(CC(C)NCc2ccccc2O)cc1	C17H21NO	unknown
+Cc1ccc(CC(C)N(C)Cc2ccccc2O)cc1	C18H23NO	unknown
+COc1ccccc1CNC(C)Cc1ccc(CO)cc1	C18H23NO2	unknown
+COc1ccccc1CN(C)C(C)Cc1ccc(CO)cc1	C19H25NO2	unknown
+CNC(C)Cc1ccc(C(=O)O)cc1	C11H15NO2	unknown
+CC(N)Cc1ccc(C(=O)O)cc1	C10H13NO2	unknown
+CC(C(O)c1ccc(C(=O)O)cc1)N(C)Cc1ccccc1O	C18H21NO4	unknown
+CC(Cc1ccc(C(=O)O)cc1)N(C)Cc1ccccc1O	C18H21NO3	unknown
+COc1ccccc1CN(C)C(C)C(O)c1ccc(C(=O)O)cc1	C19H23NO4	unknown
+CNc1nc(Cc2ccccc2)nc2c1CCNCC2C	C17H22N4	unknown
+CNc1nc(Cc2ccccc2)cc2c1CCNCC2	C17H21N3	unknown
+COc1ccc(F)cc1C1CC1CN	C11H14FNO	unknown
+COc1ccc(F)cc1C1CC1C=O	C11H11FO2	unknown
+CCC(=O)NCC1CC1c1cccc2c1CCO2	C15H19NO2	unknown
+Clc1cncc(N2CCNCC2)n1	C8H11ClN4	unknown
+COC(=O)C1(C)OC1c1ccc2c(c1)OCO2	C12H12O5	unknown
+CCCSc1cc(OC)c(/C=C/[N+](=O)[O-])cc1OC	C13H17NO4S	unknown
+O=C1CCCCC1(c1ccccc1Cl)N1CCCC1	C16H20ClNO	arylcycloalkylamine
+COc1cccc(C2(N3CCCCC3)CCCCC2=O)c1	C18H25NO2	arylcycloalkylamine
+CCCNC1(c2cccc(OC)c2)CCCCC1=O	C16H23NO2	arylcycloalkylamine
+Cc1ccc(C2(N3CCOCC3)CCCCC2)cc1	C17H25NO	arylcycloalkylamine
+CNC1(c2c(Cl)cccc2Cl)CCCCC1=O	C13H15Cl2NO	arylcycloalkylamine
+CNC1(c2cccs2)CCCCC1	C11H17NS	arylcycloalkylamine
+COc1cccc(C2(N3CCCCC3)CCCC2)c1	C17H25NO	arylcycloalkylamine
+c1ccc(C2(N3CCCCC3)CCOCC2)cc1	C16H23NO	arylcycloalkylamine
+COc1cccc(C2(N3CCCCC3)CCOCC2)c1	C17H25NO2	arylcycloalkylamine
+COC(=O)CCCCNC1(c2ccccc2Cl)CCCCC1=O	C18H24ClNO3	arylcycloalkylamine
+CC1(C)CC(O)CC(C)(C)N1C1(c2csc3ccccc23)CCCCC1	C23H33NOS	arylcycloalkylamine
+Cc1ccc(C2(N3CCCCC3)CCCc3ccccc32)cc1	C22H27N	arylcycloalkylamine
+COc1ccc(CNC2(c3ccc(OC)cc3)CCCCC2=O)cc1	C21H25NO3	arylcycloalkylamine
+COc1ccc(C2(NCc3ccc(C)cc3)CCCCC2=O)cc1	C21H25NO2	arylcycloalkylamine
+Cc1ccc(C2(N3CCC(O)CC3)CCCCC2)cc1	C18H27NO	arylcycloalkylamine
+COc1ccc(C2(N3CCC(O)CC3)CCCCC2)cc1	C18H27NO2	arylcycloalkylamine
+CN(C)C1(c2ccccc2)CCC(O)(CCc2ccccc2)CC1	C22H29NO	arylcycloalkylamine
+COc1ccc(C2(N3CCCCC3)CCCc3ccccc32)cc1	C22H27NO	arylcycloalkylamine
+c1ccc(CCN2CCC(c3ccccc3)(N3CCCCC3)CC2)cc1	C24H32N2	arylcycloalkylamine
+Cc1cccc(C2(N3CCCCC3)CCCc3ccccc32)c1	C22H27N	arylcycloalkylamine
+Cc1cccc(C2(N3CCCC(O)C3)CCCCC2)c1	C18H27NO	arylcycloalkylamine
+OC1(c2ccccc2)CCN(C2(c3ccccc3)CCCCC2)CC1	C23H29NO	arylcycloalkylamine
+Cc1ccc(C2(n3cccc3)CCCCC2)cc1	C17H21N	arylcycloalkylamine
+c1ccc(C2(N3CCCCC3)CCCCC2)nc1	C16H24N2	arylcycloalkylamine
+c1cncc(C2(N3CCCCC3)CCCCC2)c1	C16H24N2	arylcycloalkylamine
+c1cc(C2(N3CCCCC3)CCCCC2)ccn1	C16H24N2	arylcycloalkylamine
+CCCCCCCCCCC[C@@H](C[C@@H]1OC(=O)[C@H]1CCCCCC)OC(=O)[C@H](CC(C)C)NC=O	C29H53NO5	unknown
+O=C(NN1CCCCC1)c1nn(-c2ccc(Cl)cc2Cl)c2c(Cl)cccc12	C19H17Cl3N4O	cannabinoid
+CC(Cc1ccc(OCC(=O)[O-])cc1)NCC(O)c1cccc(Cl)c1.[Na+]	C19H22ClNO4.Na	unknown
+CC(Cc1ccc2c(c1)OC(C(=O)[O-])(C(=O)[O-])O2)NCC(O)c1cccc(Cl)c1.[Na+].[Na+]	C20H20ClNO7.2Na	unknown
+CC(Cc1ccc2c(c1)OCC(C(=O)O)O2)NCC(O)c1cccc(Cl)c1	C20H22ClNO5	unknown
+CCCCCCNC(=O)Nc1ccc(S(=O)(=O)Nc2ccc(CCNCC(O)c3cccnc3)cc2)cc1	C28H37N5O4S	unknown
+Nc1ccc(C(O)CNCCOc2ccc(CC(=O)O)cc2)cn1	C17H21N3O4	unknown
+O=C(O)COc1ccc(OCCNCC(O)COc2ccccc2)cc1	C19H23NO6	unknown
+CC(C)(Cc1ccc(Oc2ccc(C(N)=O)cn2)cc1)NCC(O)COc1cccc2[nH]c3ccccc3c12	C31H32N4O4	unknown
+COc1cc(-n2cnc3cc(-c4ccc(Cl)cc4)sc3c2=O)ccc1OCCN1CCCC1	C25H24ClN3O3S	unknown
+COc1ccc(CN2CCN(c3ccc(Br)c(OC)n3)CC2)cc1OC	C19H24BrN3O3	unknown
+CC1c2c([nH]c3ccc(C(F)(F)F)cc23)CC2CCN(CCC3(C(=O)O)CCCCC3)CC21	C26H33F3N2O2	unknown
+CN(C)CC1CCc2cc(NC(=O)c3ccc(-c4ccc(F)cc4)cc3)ccc2C1	C26H27FN2O	unknown
+CCN(CC)CCOc1ccc(N(C)C(=O)c2ccc(-c3ccc(C(F)(F)F)cc3)cc2)cc1OC	C28H31F3N2O3	unknown
+CCc1ccc(-c2ccc(C(=O)N(C)C3CCN(C(=O)N4CCC(N5CCCCC5)C4)C3)cc2)cc1	C30H40N4O2	unknown
+N#Cc1cccc(-c2ccc(N(CCN3CCC(O)C3)C(=O)Nc3ccc(C(F)(F)F)c(F)c3)cc2)c1	C27H24F4N4O2	unknown
+O=c1c2sc(-c3ccc(Cl)cc3)cc2ncn1Cc1cccc2cc(CN3CCC(O)CC3)cnc12	C28H25ClN4O2S	unknown
+COCC1=C(C(=O)OC)C(c2ccc(F)c(F)c2)N(C(=O)NCCCN2CCC(c3cccc(NC(C)=O)c3)CC2)C(=O)N1	C31H37F2N5O6	unknown
+Cc1cc(N2CCN(C)CC2)nc2ccc(NC(=O)COc3ccc(Cl)cc3)cc12	C23H25ClN4O2	unknown
+c1ccc(CCNCCc2c[nH]c3ccccc23)cc1	C18H20N2	tryptamine
+c1ccc2c(CCN3CCCCCC3)c[nH]c2c1	C16H22N2	tryptamine
+CC[C@H]1C[C@@H]2C[C@H]3c4[nH]c5ccc(O)cc5c4CCN(C2)[C@@H]13	C19H24N2O	unknown
+Nc1ccccc1C(=O)O	C7H7NO2	unknown
+N#CCc1ccccc1	C8H7N	unknown
+O=C(O)Cc1ccccc1	C8H8O2	unknown
+CCN1CCCC(OC(=O)C(O)(c2ccccc2)c2ccccc2)C1	C21H25NO3	unknown
+CN(C)CCCc1ccccc1	C11H17N	unknown
+CN(C)CCNc1ccccc1	C10H16N2	unknown
+CN(C)CCC1CCc2ccccc21	C13H19N	unknown
+CN(C)CCN1CCc2ccccc21	C12H18N2	unknown
+CN(C)CCn1ccc2ccccc21	C12H16N2	unknown
+COc1ccc2ccn(CCN(C)C)c2c1	C13H18N2O	unknown
+COc1ccc2c(ccn2CCN(C)C)c1	C13H18N2O	unknown
+Cc1cccc2ccn(CCN(C)C)c12	C13H18N2	unknown
+Cc1ccc2ccn(CCN(C)C)c2c1	C13H18N2	unknown
+Cc1ccc2c(ccn2CCN(C)C)c1	C13H18N2	unknown
+CCN(CCN(C)C)c1ccccc1	C12H20N2	unknown
+CN(C)CCn1cnc2ccccc21	C11H15N3	unknown
+CN(C)CCc1cn(CCN(C)C)c2ccccc12	C16H25N3	tryptamine
+CC(=O)CCc1ccc2c(c1)OCO2	C11H12O3	unknown
+CC(=O)OCC[N+](C)(C)C	C7H16NO2	unknown
+O=C(OC1CCCNC1)C(O)(c1ccccc1)c1ccccc1	C19H21NO3	unknown
+C=CCN1CCCC(OC(=O)C(O)(c2ccccc2)c2ccccc2)C1	C22H25NO3	unknown
+CN(C)NCCN1CCCC(OC(=O)C(O)(c2ccccc2)c2ccccc2)C1	C23H31N3O3	unknown
+CN1CCCC(OC(=O)C(O)(c2ccccc2)c2cccs2)C1	C18H21NO3S	unknown
+CN(C)CCN1CCCC(OC(=O)C(O)(c2ccccc2)c2ccccc2)C1	C23H30N2O3	unknown
+CCN1CCCC(OC(=O)C(O)(c2ccccc2)C2CCCC2)C1	C20H29NO3	unknown
+CCN1CCCC(OC(=O)C(O)(c2ccccc2)C2CCCC2)C1.CCN1CCCC(OC(=O)C(O)(c2ccccc2)C2CCCC2)C1.CCN1CCCC(OC(=O)C(O)(c2ccccc2)C2CCCC2)C1.CCN1CCCC1COC(=O)C(O)(c1ccccc1)C1CCCC1.CCN1CCCC1COC(=O)C(O)(c1ccccc1)C1CCCC1.CCN1CCCC1COC(=O)C(O)(c1ccccc1)C1CCCC1.CCN1CCCC1COC(=O)C(O)(c1ccccc1)C1CCCC1.CCN1CCCC1COC(=O)C(O)(c1ccccc1)C1CCCC1.CCN1CCCC1COC(=O)C(O)(c1ccccc1)C1CCCC1.CCN1CCCC1COC(=O)C(O)(c1ccccc1)C1CCCC1	10C20H29NO3	unknown
+CCN(CC)CCOC(=O)C(O)(c1cccs1)C1CCCC1	C17H27NO3S	unknown
+CCN1CCCC(OC(=O)C(O)(c2ccccc2)C2CCCCC2)C1	C21H31NO3	unknown
+NCCCC(=O)O	C4H9NO2	unknown
+COC1=CC(=O)OC(/C=C/c2ccccc2)C1	C14H14O3	unknown
+COC1=CC(=O)OC(/C=C/c2ccc3c(c2)OCO3)C1	C15H14O5	unknown
+CC(O)NC(=O)[C@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C18H21N3O2	unknown
+COc1cc(OC)c(CC(C)N)cc1O	C11H17NO3	unknown
+COc1cc(O)c(CC(C)N)cc1OC	C11H17NO3	unknown
+COc1cc(CC(C)N)cc(OC)c1SC	C12H19NO2S	unknown
+CC(N)c1ccc(Cl)cc1	C8H10ClN	unknown
+CC(Cc1ccc(Cl)cc1)NC1CC1	C12H16ClN	unknown
+C/C(Cc1ccc(Cl)cc1)=N\O	C9H10ClNO	unknown
+Clc1ccc(CCNCCc2ccc(Cl)c(Cl)c2)cc1Cl	C16H15Cl4N	unknown
+COC(=O)C(c1ccccc1)C1CCCNC1	C14H19NO2	unknown
+OC(CC1CCCCN1)(c1ccccc1)c1ccccc1	C19H23NO	unknown
+CC(Cc1ccc(Cl)cc1)N(C)Cc1ccccc1	C17H20ClN	unknown
+CC(C)(N)Cc1cccc(Cl)c1	C10H14ClN	unknown
+CC(C)(N)Cc1ccc(Br)cc1	C10H14BrN	unknown
+Cc1ccc(CC(C)(C)N)cc1	C11H17N	unknown
+CC(C)(N)Cc1ccc(O)cc1	C10H15NO	unknown
+CC(Cc1ccccc1)N(C)Cc1ccccc1Cl	C17H20ClN	unknown
+CC(Cc1ccccc1)NCc1ccc(Cl)cc1	C16H18ClN	unknown
+CC(Cc1ccccc1)N(C)Cc1ccc(Cl)cc1	C17H20ClN	unknown
+CC(Cc1ccccc1)NCc1ccc(Br)cc1	C16H18BrN	unknown
+CC(Cc1ccccc1)N(C)Cc1ccc(Br)cc1	C17H20BrN	unknown
+CC(Cc1ccccc1)NCc1ccc(F)cc1	C16H18FN	unknown
+CC(Cc1ccccc1)N(C)Cc1ccc(F)cc1	C17H20FN	unknown
+Cc1ccc(CNC(C)Cc2ccccc2)cc1	C17H21N	unknown
+Cc1ccc(CN(C)C(C)Cc2ccccc2)cc1	C18H23N	unknown
+COc1ccc(CNC(C)Cc2ccccc2)cc1	C17H21NO	unknown
+COc1ccc(CN(C)C(C)Cc2ccccc2)cc1	C18H23NO	unknown
+CC(Cc1ccccc1)NCc1cccc(C(F)(F)F)c1	C17H18F3N	unknown
+CC(Cc1ccccc1)N(C)Cc1cccc(C(F)(F)F)c1	C18H20F3N	unknown
+CC(Cc1ccccc1)NCc1ccco1	C14H17NO	unknown
+CC(Cc1ccccc1)N(C)Cc1ccco1	C15H19NO	unknown
+CC(Cc1ccccc1)NCC1CCCO1	C14H21NO	unknown
+CC(Cc1ccccc1)N(C)CC1CCCO1	C15H23NO	unknown
+CC(Cc1ccccc1)NCc1cccs1	C14H17NS	unknown
+CC(Cc1ccccc1)N(C)Cc1cccs1	C15H19NS	unknown
+CC(Cc1ccccc1)NCc1ccsc1	C14H17NS	unknown
+CC(Cc1ccccc1)N(C)Cc1ccsc1	C15H19NS	unknown
+CC(Cc1ccc(C(F)(F)F)cc1)NCCOC(=O)c1ccccc1	C19H20F3NO2	unknown
+CC(Cc1ccccc1C(F)(F)F)NCCOC(=O)c1ccccc1	C19H20F3NO2	unknown
+CC(N)CCc1cccc(C(F)(F)F)c1	C11H14F3N	unknown
+CCC(N)Cc1cccc(C(F)(F)F)c1	C11H14F3N	unknown
+CC(C)(N)Cc1cccc(C(F)(F)F)c1	C11H14F3N	unknown
+CNC(C)Cc1cccc(C(F)(F)F)c1	C11H14F3N	unknown
+CCCNC(C)Cc1cccc(C(F)(F)F)c1	C13H18F3N	unknown
+CC(C)NC(C)Cc1cccc(C(F)(F)F)c1	C13H18F3N	unknown
+CCCCNC(C)Cc1cccc(C(F)(F)F)c1	C14H20F3N	unknown
+CC(Cc1cccc(C(F)(F)F)c1)NCCCl	C12H15ClF3N	unknown
+C=CCNC(C)Cc1cccc(C(F)(F)F)c1	C13H16F3N	unknown
+C#CCNC(C)Cc1cccc(C(F)(F)F)c1	C13H14F3N	unknown
+CC=CCNC(C)Cc1cccc(C(F)(F)F)c1	C14H18F3N	unknown
+CC(C)=CCNC(C)Cc1cccc(C(F)(F)F)c1	C15H20F3N	unknown
+CC(Cc1cccc(C(F)(F)F)c1)N(C)C	C12H16F3N	unknown
+CCN(CC)C(C)Cc1cccc(C(F)(F)F)c1	C14H20F3N	unknown
+CCCCN(C)C(C)Cc1cccc(C(F)(F)F)c1	C15H22F3N	unknown
+C#CCN(C)C(C)Cc1cccc(C(F)(F)F)c1	C14H16F3N	unknown
+CC(Cc1cccc(C(F)(F)F)c1)N(C)CC#Cc1ccccc1	C20H20F3N	unknown
+CC(Cc1cccc(C(F)(F)F)c1)[N+](C)(C)C	C13H19F3N	unknown
+CC(=O)NC(C)Cc1cccc(C(F)(F)F)c1	C12H14F3NO	unknown
+CCC(=O)NC(C)Cc1cccc(C(F)(F)F)c1	C13H16F3NO	unknown
+CC(Cc1cccc(C(F)(F)F)c1)NC(=O)CCl	C12H13ClF3NO	unknown
+CC(Cc1cccc(C(F)(F)F)c1)NC(=O)c1ccccc1	C17H16F3NO	unknown
+CC(Cc1cccc(C(F)(F)F)c1)NC(N)=O	C11H13F3N2O	unknown
+CC(Cc1cccc(C(F)(F)F)c1)NC(=O)CCN1CCCCC1	C18H25F3N2O	unknown
+CC(Cc1cccc(C(F)(F)F)c1)NCCCO	C13H18F3NO	unknown
+CCOCCNC(C)Cc1cccc(C(F)(F)F)c1	C14H20F3NO	unknown
+CC(Cc1cccc(C(F)(F)F)c1)NCCOc1ccccc1	C18H20F3NO	unknown
+CC(=O)OCCNC(C)Cc1cccc(C(F)(F)F)c1	C14H18F3NO2	unknown
+CCC(=O)OCCNC(C)Cc1cccc(C(F)(F)F)c1	C15H20F3NO2	unknown
+CC(Cc1cccc(C(F)(F)F)c1)NCCOC(=O)c1ccc(F)cc1	C19H19F4NO2	unknown
+CC(Cc1cccc(C(F)(F)F)c1)NCCOC(=O)c1ccc(Cl)cc1	C19H19ClF3NO2	unknown
+Cc1ccc(C(=O)OCCNC(C)Cc2cccc(C(F)(F)F)c2)cc1	C20H22F3NO2	unknown
+CC(Cc1cccc(C(F)(F)F)c1)NCCOC(=O)c1ccc(N)cc1	C19H21F3N2O2	unknown
+CC(Cc1cccc(C(F)(F)F)c1)NCCOC(=O)c1ccc([N+](=O)[O-])cc1	C19H19F3N2O4	unknown
+CC(Cc1cccc(C(F)(F)F)c1)NCCOC(=O)c1cccc(C(F)(F)F)c1	C20H19F6NO2	unknown
+CC(Cc1cccc(C(F)(F)F)c1)NCCOC(=O)Cc1ccccc1	C20H22F3NO2	unknown
+CC(Cc1cccc(C(F)(F)F)c1)NCCC(=O)O	C13H16F3NO2	unknown
+CC(Cc1cccc(C(F)(F)F)c1)NCC(N)=O	C12H15F3N2O	unknown
+CNC(=O)CNC(C)Cc1cccc(C(F)(F)F)c1	C13H17F3N2O	unknown
+CC(Cc1cccc(C(F)(F)F)c1)NCC(=O)N(C)C	C14H19F3N2O	unknown
+CC(Cc1cccc(C(F)(F)F)c1)NCC(=O)NN	C12H16F3N3O	unknown
+C[C@@]12CCCCC[C@@H](Cc3ccc(O)cc31)[C@@H]2N	C16H23NO	unknown
+CO/C(=C/C(=O)O)CC(O)/C=C/c1ccc2c(c1)OCO2	C15H16O6	unknown
+COC1=CC(=O)OC(CCc2ccc3c(c2)OCO3)C1	C15H16O5	unknown
+COc1cc(/C=C/c2ccc3c(c2)OCO3)oc(=O)c1	C15H12O5	unknown
+COC1=CC(=O)OC(CCc2ccccc2)C1	C14H16O3	unknown
+COc1cc(/C=C/c2ccccc2)oc(=O)c1	C14H12O3	unknown
+COc1ccc(/C=C/c2cc(OC)cc(=O)o2)cc1	C15H14O4	unknown
+COc1cc(/C=C/c2ccc(OC)c(OC)c2)oc(=O)c1	C16H16O5	unknown
+COc1cc(/C=C/c2ccc(O)c(OC)c2)oc(=O)c1	C15H14O5	unknown
+COc1ccc(/C=C/C(=O)c2c(O)cc(OC)cc2OC)cc1	C18H18O5	unknown
+COc1cc(O)c(C(=O)/C=C/c2ccccc2)c(OC)c1	C17H16O4	unknown
+COc1cc(O)c(C(=O)/C=C/c2ccccc2)c(O)c1	C16H14O4	unknown
+COc1cc(O)cc(O)c1C(=O)/C=C/c1ccccc1	C16H14O4	unknown
+COc1cc(O)c2c(c1)OC(c1ccccc1)CC2=O	C16H14O4	unknown
+COc1cc(O)cc2c1C(=O)CC(c1ccccc1)O2	C16H14O4	unknown
+COc1c(O)cc2c(c1O)C(=O)CC(c1ccccc1)O2	C16H14O5	unknown
+CC(=O)/C=C/C=C/c1ccccc1	C12H12O	unknown
+CC(=O)/C=C/C=C/c1ccc2c(c1)OCO2	C13H12O3	unknown
+COC1=CC(=O)OC(CCc2ccccc2)C1O	C14H16O4	unknown
+CCOC1=CC(=O)OC(/C=C/c2ccc3c(c2)OCO3)C1	C16H16O5	unknown
+O=C(/C=C/C=C/c1ccc2c(c1)OCO2)N1CCCCC1	C17H19NO3	unknown
+COc1cc(/C=C/C(=O)N2CCCCC2)cc(OC)c1OC	C17H23NO4	unknown
+COc1cc(/C=C/C(=O)N2C=CCCC2=O)cc(OC)c1OC	C17H19NO5	unknown
+COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC	C17H19NO5	unknown
+CC(C)CNC(=O)/C=C/C=C/c1ccc2c(c1)OCO2	C16H19NO3	unknown
+COc1c(/C=C/C(=O)N2CCCC2)cc2c(c1OC)OCO2	C16H19NO5	unknown
+CCCCCCCCCC/C=C/c1ccc2c(c1)OCO2	C19H28O2	unknown
+O=C(/C=C/C=C/c1ccc2c(c1)OCO2)N1CCCC1	C16H17NO3	unknown
+COc1cc(-c2ccccc2)oc(=O)c1	C12H10O3	unknown
+COc1cc(-c2ccc3c(c2)OCO3)oc(=O)c1	C13H10O5	unknown
+Cc1cccc2c1ccn2CCN(C)C	C13H18N2	unknown
+CCCNC1(c2cccs2)CCCCC1	C13H21NS	arylcycloalkylamine
+CCCNC1(c2ccccc2Cl)CCCCC1=O	C15H20ClNO	arylcycloalkylamine
+NC1(c2ccccc2Cl)CCCC(O)C1=O	C12H14ClNO2	arylcycloalkylamine
+c1ccc2sc(C3(N4CCCC4)CCCCC3)cc2c1	C18H23NS	arylcycloalkylamine
+O=C(OC1CCN(C2(c3ccccc3)CCCCC2)CC1)c1ccccc1	C24H29NO2	arylcycloalkylamine
+FC1CCN(C2(c3cccs3)CCCCC2)CC1	C15H22FNS	arylcycloalkylamine
+FCCc1ccc(C2(N3CCCCC3)CCCCC2)s1	C17H26FNS	arylcycloalkylamine
+CC(=O)Oc1cccc(C2(N3CCCCC3)CCCCC2)c1	C19H27NO2	arylcycloalkylamine
+O=C1CCN(C2(c3ccccc3)CCCCC2)CC1	C17H23NO	arylcycloalkylamine
+Oc1ccccc1C1(N2CCCCC2)CCCCC1	C17H25NO	arylcycloalkylamine
+c1ccc(C2(N3CCC3)CCCCC2)cc1	C15H21N	arylcycloalkylamine
+C1=CCN(C2(c3cccs3)CCCCC2)CC1	C15H21NS	arylcycloalkylamine
+Cc1csc(C2(N3CC=CCC3)CCCCC2)c1	C16H23NS	arylcycloalkylamine
+CC1CCC(c2cccs2)(N2CC=CCC2)CC1	C16H23NS	arylcycloalkylamine
+CN(C)C[C@H]1CN(C2(c3ccccc3)CCCCC2)CC[C@]1(O)c1cccc(O)c1	C26H36N2O2	arylcycloalkylamine
+CN(C)C[C@H]1CN(C2(c3ccccc3)CCCCC2)CC[C@@]1(C)O	C21H34N2O	arylcycloalkylamine
+CC1=CCCN(C2(c3ccc(C)s3)CCCCC2)C1	C17H25NS	arylcycloalkylamine
+Fc1ccc(C2(N3CCCCC3)CC3CCC2CC3)cc1	C19H26FN	arylcycloalkylamine
+Cc1csc(C2(N3CCCCC3)CCSCC2)c1	C15H23NS2	arylcycloalkylamine
+CC1CCCN(C2(c3cccs3)CCSCC2)C1	C15H23NS2	arylcycloalkylamine
+c1coc(C2(N3CCCCC3)CCCCC2)c1	C15H23NO	arylcycloalkylamine
+CCC(=O)N(c1ccccc1)C1CCN(C2(c3ccccc3)CCCCC2)CC1	C26H34N2O	arylcycloalkylamine
+CC1CCCN(C2(c3cccs3)CCCCC2)C1	C16H25NS	arylcycloalkylamine
+COc1cc(/C=C/[N+](=O)[O-])cc(SC)c1OC	C11H13NO4S	unknown
+CCCCCn1ccc2c(C(=O)c3ccccc3)cccc21	C20H21NO	unknown
+CCCCCn1ccc2cc(C(=O)c3ccccc3)ccc21	C20H21NO	unknown
+CCCCCn1c(C(=O)c2ccccc2)cc2ccccc21	C20H21NO	unknown
+O=C(NC1C2CC3CC(C2)CC1C3)c1nn(CCCCCCl)c2ccccc12	C23H30ClN3O	cannabinoid
+CCCC(C(=O)c1cc(Br)c(Br)s1)N1CCCC1	C13H17Br2NOS	unknown
+O=C(NC1C2CC3CC(C2)CC1C3)c1nn(CCCCCF)c2ccccc12	C23H30FN3O	cannabinoid
+CCCCCn1ccc2ccc(C(=O)c3ccccc3)cc21	C20H21NO	unknown
+CCCCCn1ccc2cccc(C(=O)c3ccccc3)c21	C20H21NO	unknown
+CCc1cc(OC)c(C(O)C#N)cc1OC	C12H15NO3	unknown
+CCc1cc(OC)c(CC(N)=O)cc1OC	C12H17NO3	unknown
+CCc1cc(OC)c(C(O)CN)cc1OC	C12H19NO3	unknown
+COc1ccc(OC)c(/C=C/N)c1	C10H13NO2	unknown
+CCc1cc(OC)c(CCNOC(C)=O)cc1OC	C14H21NO4	unknown
+CNC(C)Cc1cccc2occc12	C12H15NO	unknown
+CNC(C)Cc1cccc2ccoc12	C12H15NO	unknown
+CCNC(C)Cc1cccc2occc12	C13H17NO	unknown
+CN1CC[C@]23c4c5ccc(O)c4O[C@@]2(CO)C(=O)CC[C@@]3(O)[C@H]1C5	C18H21NO5	unknown
+N=C(N)Nc1ccc2c3c([nH]c2c1)[C@@H]1Oc2c(O)ccc4c2[C@@]12CCN(CC1CC1)[C@H](C4)[C@]2(O)C3	C27H29N5O3	unknown
+Oc1ccc2c3c1O[C@H]1[C@@H](O)CC[C@@]4(O)[C@@H](C2)N(CC2CCC2)CC[C@]314	C21H27NO4	unknown
+Oc1ccc2c(c1)[C@@]13CCCC[C@H]1[C@@H](C2)N(CC1CCC1)CC3	C21H29NO	unknown
+Cc1cc(NCC(=O)Nc2ccccc2)c2ccccc2n1	C18H17N3O	unknown
+Nc1nc2cc3c(cc2s1)C[C@@H]1[C@@H]2CCCC[C@]32CCN1CC1CC1	C21H27N3S	unknown
+O=C(N[C@@H]1CC[C@@]2(O)[C@H]3Cc4ccc(O)c5c4[C@@]2(CCN3CC2CC2)[C@H]1O5)c1cc[n+](Cc2ccccc2)cc1.[Br-]	C33H35N3O4.BrH	unknown
+CO[C@]12CC[C@@]3(C[C@@H]1[C@](C)(O)CCc1ccsc1)[C@H]1Cc4ccc(O)c5c4[C@@]3(CCN1C)[C@H]2O5	C28H35NO4S	unknown
+CO[C@]12CC[C@@]3(C[C@@H]1[C@](C)(O)C(C)(C)C)[C@H]1Cc4ccc(O)c5c4[C@@]3(CCN1CC1CC1)[C@H]2O5	C29H41NO4	unknown
+CCC(C)(C)[C@@](C)(O)[C@H]1C[C@@]23CC[C@]1(OC)[C@@H]1Oc4c(O)ccc5c4[C@@]12CCN(CC1CC1)[C@@H]3C5	C30H43NO4	unknown
+CN(C)[C@]1(c2ccccc2)CC[C@]2(CC1)OCCc1c3cc(F)ccc3[nH]c12	C24H27FN2O	unknown
+CN(C(=O)/C=C/c1ccoc1)[C@@H]1CC[C@@]2(O)[C@H]3Cc4ccc(O)c5c4[C@@]2(CCN3CC2CC2)[C@H]1O5	C28H32N2O5	unknown
+C=CCN1CC[C@]23c4c5ccc(O)c4O[C@H]2/C(=N/NC(=O)c2ccccc2)CC[C@@]3(O)[C@H]1C5	C26H27N3O4	unknown
+O=C1Cc2ccccc2N1C1CCN(C2C3CCCC2CCC3)CC1	C22H30N2O	unknown
+O=C1Cc2ccccc2N1C1CCN(C2CCCCCCC2)CC1	C21H30N2O	unknown
+COc1ccc2c3c1O[C@H]1c4c(c5cccc6c5n4CCC6)C[C@@]4(O)[C@@H](C2)N(CC2CC2)CC[C@]314	C30H32N2O3	unknown
+Oc1ccc2c3c1O[C@H]1c4c(c5cc(F)cc6c5n4CCC6)C[C@@]4(O)[C@@H](C2)N(CC2CC2)CC[C@]314	C29H29FN2O3	unknown
+Oc1ccc2c3c1O[C@H]1c4[nH]c5ccccc5c4C[C@@]4(O)[C@@H](C2)N(CC2CC2)CC[C@]314	C26H26N2O3	unknown
+CN1CC[C@]2(c3cccc(O)c3)Cc3nc4ccccc4cc3C[C@H]2C1	C23H24N2O	unknown
+CN1CC[C@]23Cc4nc5ccccc5cc4C[C@H]2[C@H]1Cc1ccc(O)cc13	C24H24N2O	unknown
+CN1CC[C@]23Cc4nc5ccccc5cc4C[C@@]2(O)[C@H]1Cc1ccc(O)cc13	C24H24N2O2	unknown
+CC(C)NCC(O)COc1cccc2[nH]c(C#N)c(I)c12	C15H18IN3O2	unknown
+CN1C[C@@H](NS(=O)(=O)N(C)C)C[C@@H]2c3cccc4c3c(cn4C)C[C@H]21	C18H26N4O2S	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C(C)C)C1	C22H29N3O	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C#N)C1	C20H22N4O	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(CC2CC2)C1	C23H29N3O	unknown
+C/C=C/CN1C[C@H](C(=O)N(CC)CC)C=C2c3cccc4[nH]cc(c34)C[C@H]21	C23H29N3O	unknown
+C=CCCN1C[C@H](C(=O)N(CC)CC)C=C2c3cccc4[nH]cc(c34)C[C@H]21	C23H29N3O	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(CC(C)C)C1	C23H31N3O	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2[N+](C)(C)C1.[Br-]	C21H28N3O.BrH	unknown
+COc1ccc2[nH]c3c(c2c1)CCN(C)C3C	C14H18N2O	unknown
+CCCCCc1cc(O)c2c(c1C(=O)O)OC(C)(C)[C@@H]1CCC(C)=CC21	C22H30O4	cannabinoid
+C=C(C)[C@@H]1CCC(C)=CC1c1c(O)cc(CCCCC)cc1OC	C22H32O2	cannabinoid
+C=C(C)[C@@H]1CCC(C)=C[C@H]1c1c(O)cc(CCCCC)c(C(=O)OC2(C)CCC3=C(c4c(O)cc(CCCCC)cc4OC3(C)C)C2O)c1O	C43H58O7	cannabinoid
+CCCc1cc2c(c(O)c1C(=O)O)C1C=C(C)CC[C@H]1C(C)(C)O2	C20H26O4	cannabinoid
+CC1=CC2c3c(O)cc(C)cc3OC(C)(C)[C@@H]2CC1	C17H22O2	cannabinoid
+C=C(C)[C@@H]1CCC(C)=CC1c1c(O)cc(C)cc1O	C17H22O2	cannabinoid
+CCCCCc1cc2c(c(O)c1C(=O)O)-c1cc(C)ccc1C(C)(C)O2	C22H26O4	cannabinoid
+CCCCCc1cc(OC)c2c(c1)OC(C)(C)c1ccc(C)cc1-2	C22H28O2	cannabinoid
+CCCc1cc(O)c2c(c1)OC(C)(C)c1ccc(C)cc1-2	C19H22O2	cannabinoid
+Cc1cc(O)c2c(c1)OC(C)(C)c1ccc(C)cc1-2	C17H18O2	cannabinoid
+CCCCCc1cc(O)cc2c1C1C=C(C)CC[C@H]1C(C)(C)O2	C21H30O2	cannabinoid
+CCCCCc1cc(O)c2c(c1)OC(C)(C)C1=C2CN(C)CC1	C20H29NO2	cannabinoid
+CCCCCc1cc(O)c2c(c1)OC(C)(C)C1=C2CCN(C)C1	C20H29NO2	cannabinoid
+CCCCCc1cc(O)c2c(c1)OC(C)(C)C1=C2C2CCN1CC2	C21H29NO2	cannabinoid
+CCCCCc1cc(O)c2c(c1)N(C)C(C)(C)C1=C2CC(C)CC1	C22H33NO	cannabinoid
+CC1CCC2=C(C1)c1c(O)cc(CCN(C)C)cc1OC2(C)C	C20H29NO2	cannabinoid
+CCCCCCCC(C)c1cc(O)c2c(c1)OC(C)(C)C1=C2CC(C)CC1	C25H38O2	cannabinoid
+CCCCCc1cc(OC(=O)N(C)C)c2c(c1)OC(C)(C)C1=C2CC(C)CC1	C24H35NO3	cannabinoid
+CCCCCc1cc2c(c(OP(C)(=O)OC(C)C)c1)C1=C(CCC(C)C1)C(C)(C)O2	C25H39O4P	cannabinoid
+Cc1cc(O)c2c(c1)SC(C)(C)C1=C2CC(C)CC1	C17H22OS	unknown
+Cc1cc(O)c2c(c1)OC(C)(C)C1=C2CC(C)CC1	C17H22O2	unknown
+c1ccc(C2CCCCC2N2CCCC2)cc1	C16H23N	arylcycloalkylamine
+Cn1cc(O)c2cc(O)c(O)cc21	C9H9NO3	unknown
+COc1cc(C(=O)CCN2CCCCC2)cc2c1OCO2	C16H21NO4	unknown
+COc1cc(C(=O)CCN2CCCC2)cc2c1OCO2	C15H19NO4	unknown
+COc1ccc(C(=O)N2CCCC2=O)cc1	C12H13NO3	unknown
+CCC[C@@H]1CC(=O)N([C@@H](CC)C(N)=O)C1	C11H20N2O2	unknown
+O=C1CN(C(=O)CN2CC(c3ccc(Cl)cc3)CC2=O)CCN1	C16H18ClN3O3	unknown
+Cc1oc2nc3c(c(NC(=O)CN4CCCC4=O)c2c1C)CCCC3	C19H23N3O3	unknown
+O=C1CN2C(=O)CCC2N1	C6H8N2O2	unknown
+NC(=O)CN1C(=O)C(c2ccccc2)c2ccccc21	C16H14N2O2	unknown
+O=C(CN1CCCC1=O)NNC(=O)CN1CCCC1=O	C12H18N4O4	unknown
+CCC(C(N)=O)N1CCCC1=O	C8H14N2O2	unknown
+CC[C@@H](C(N)=O)N1CCCC1=O	C8H14N2O2	unknown
+O=C1CC[C@H](C(=O)N2CCCCC2)N1	C10H16N2O2	unknown
+O=C(NCN1CCCC1=O)NCN1CCCC1=O	C11H18N4O3	unknown
+C[C@H]1[C@@H](c2ccccc2)CC(=O)N1CC(N)=O	C13H16N2O2	unknown
+NCC1CC(=O)N(Cc2ccccc2)C1	C12H16N2O	unknown
+Cc1cccc(C)c1NC(=O)CN1CCCC1=O	C14H18N2O2	unknown
+CCOC(=O)CNC(=O)[C@@H]1CCCN1C(=O)Cc1ccccc1	C17H22N2O4	unknown
+NC(=O)CN1CC(O)CC1=O	C6H10N2O3	unknown
+NNC(=O)CN1CC(c2ccccc2)CC1=O	C12H15N3O2	unknown
+NC(=O)CN1CCCC1=O	C6H10N2O2	unknown
+CC(C)N(CCNC(=O)CN1CCCC1=O)C(C)C	C14H27N3O2	unknown
+O=C1CCC2CCC(=O)N12	C7H9NO2	unknown
+CC[C@@H](C(N)=O)N1C[C@@H](C=C(F)F)CC1=O	C10H14F2N2O2	unknown
+CCCCCCCc1cc(O)c2c(c1)OC(C)(C)C1=C2CC(C)CC1	C23H34O2	cannabinoid
+CCCCCCC(C)(C)c1cc(O)c2c(c1)OC(C)(C)C1=C2CC(C)CC1	C25H38O2	cannabinoid
+CCCCCCCC/C=C\CCCCCCCC(N)=O	C18H35NO	cannabinoid
+CCCCCCC(C)(C)c1cc(O)c(-c2n(C)c3ccccc3[n+]2C)c(O)c1.[Br-]	C24H32N2O2.BrH	cannabinoid
+Cc1ccc(C(=O)c2cn(CCCC(C)F)c3ccccc23)c2ccccc12	C25H24FNO	cannabinoid
+CCC(C(=O)c1ccc(Br)s1)N1CCCC1	C12H16BrNOS	unknown
+CCC(C(=O)c1cc(Br)cs1)N1CCCC1	C12H16BrNOS	unknown
+CCC(C(=O)c1sccc1Br)N1CCCC1	C12H16BrNOS	unknown
+CCCC(C(=O)c1ccc(Br)s1)N1CCCC1	C13H18BrNOS	unknown
+CCCC(C(=O)c1cc(Br)cs1)N1CCCC1	C13H18BrNOS	unknown
+CCCC(C(=O)c1sccc1Br)N1CCCC1	C13H18BrNOS	unknown
+CC1=CC[C@@H]2[C@@H](C1)c1c(O)cc(C(C)(C)CCCCCCBr)cc1OC2(C)C	C25H37BrO2	cannabinoid
+CC1=CC[C@@H]2[C@@H](C1)c1c(O)cc(/C(C)=N/OCCCC(F)(F)F)cc1OC2(C)C	C22H28F3NO3	cannabinoid
+CC1=CC[C@@H]2[C@@H](C1)c1c(O)cc(/C(C)=N/OCCCC#N)cc1OC2(C)C	C22H28N2O3	cannabinoid
+COc1cc(CC(C)N)cc(SC)c1OC	C12H19NO2S	unknown
+COc1cc(OC)c(CCN(C)Cc2ccccc2OC)c(OC)c1	C20H27NO4	unknown
+COc1cc(OC)c(CCN(Cc2ccccc2OC)C(C)=O)c(OC)c1	C21H27NO5	unknown
+COc1cc(OC)c(CCN(Cc2ccccc2OC)C(=O)C(F)(F)F)c(OC)c1	C21H24F3NO5	unknown
+COc1ccccc1CN(CCc1c(OC)cc(OC)c(C(=O)C(F)(F)F)c1OC)C(=O)C(F)(F)F	C23H23F6NO6	unknown
+CC(=O)N(C)C(C)Cc1cccs1	C10H15NOS	unknown
+CC(Cc1cccs1)N(C)C	C9H15NS	unknown
+NC1C2CCC(C2)C1c1c[nH]c2ccccc12	C15H18N2	tryptamine
+COc1ccc2[nH]cc(C3C4CCC(C4)C3N)c2c1	C16H20N2O	tryptamine
+COc1cc(SCCO)c(OC)cc1CCN	C12H19NO3S	unknown
+COc1c(Cl)c(Cl)c(OC)c(CC(C)N)c1Cl	C11H14Cl3NO2	unknown
+COc1c(I)c(CCN)c(I)c(OC)c1OC	C11H15I2NO3	unknown
+CCC(=O)n1cc2c3c(cccc31)C1=C[C@@H](C(=O)N(C)C(C)C)CN(C)[C@@H]1C2	C23H29N3O2	unknown
+CCCC(=O)n1cc2c3c(cccc31)C1=C[C@@H](C(=O)N(CC)CC)CN(C)[C@@H]1C2	C24H31N3O2	unknown
+CCCn1c(C)c(C(=O)c2ccc(CC)c3ccccc23)c2ccccc21	C25H25NO	cannabinoid
+CCCCCn1cc(C(=O)Cc2ccc(Cl)cc2)c2ccccc21	C21H22ClNO	cannabinoid
+CCCCCn1c(C)c(C(=O)Cc2ccc(Cl)cc2)c2ccccc21	C22H24ClNO	cannabinoid
+CCCCCn1cc(C(=O)Cc2ccc(C)cc2)c2ccccc21	C22H25NO	cannabinoid
+CCCCCn1c(C)c(C(=O)Cc2ccc(C)cc2)c2ccccc21	C23H27NO	cannabinoid
+CCCCCn1cc(C(=O)Cc2cccc(Cl)c2)c2ccccc21	C21H22ClNO	cannabinoid
+CCCCCn1c(C)c(C(=O)Cc2cccc(OC)c2)c2ccccc21	C23H27NO2	cannabinoid
+CCCCCn1cc(C(=O)Cc2ccccc2F)c2ccccc21	C21H22FNO	cannabinoid
+CCCCCn1cc(C(=O)Cc2cccc(F)c2)c2ccccc21	C21H22FNO	cannabinoid
+CCCCCn1c(C)c(C(=O)Cc2ccc(F)cc2)c2ccccc21	C22H24FNO	cannabinoid
+CCCCCn1c(C)c(C(=O)Cc2ccccc2Br)c2ccccc21	C22H24BrNO	cannabinoid
+CCCCCn1c(C)c(C(=O)Cc2ccccc2OC)c2ccccc21	C23H27NO2	cannabinoid
+O=C(O)CCCCn1cc(C(=O)c2cccc3ccccc23)c2ccccc21	C24H21NO3	cannabinoid
+COc1ccc(O)cc1C=O	C8H8O3	unknown
+COc1ccc(O)cc1/C=C/[N+](=O)[O-]	C9H9NO4	unknown
+COc1ccc(O)cc1CCNC(=O)C(F)(F)F	C11H12F3NO3	unknown
+COc1cc(Cl)c(O)cc1CCNC(=O)C(F)(F)F	C11H11ClF3NO3	unknown
+COc1cc(Cl)c(O)cc1CCNCc1ccccc1OC	C17H20ClNO3	unknown
+COc1ccc(O)c(/C=C/[N+](=O)[O-])c1	C9H9NO4	unknown
+COc1ccc(OC(C)=O)c(CCNC(=O)C(F)(F)F)c1	C13H14F3NO4	unknown
+COc1cc(CCNC(=O)C(F)(F)F)c(OC(C)=O)cc1Cl	C13H13ClF3NO4	unknown
+COc1cc(CCNC(=O)C(F)(F)F)c(OC(C)=O)cc1I	C13H13F3INO4	unknown
+COc1cc(CCNCc2ccccc2OC)c(O)cc1Cl	C17H20ClNO3	unknown
+COc1cc(CCNCc2ccccc2OC)c(O)cc1I	C17H20INO3	unknown
+COc1ccc(OC)c(CCNC(=O)OC(C)(C)C)c1	C15H23NO4	unknown
+COc1cc(CCNC(=O)OC(C)(C)C)c(OC)cc1Cl	C15H22ClNO4	unknown
+COc1cc(CCNCc2cc(O)ccc2OC)c(OC)cc1Cl	C18H22ClNO4	unknown
+COc1cc(CCNCc2cc(O)ccc2OC)c(OC)cc1I	C18H22INO4	unknown
+COc1cc(CCNCc2ccc(O)cc2OC)c(OC)cc1Cl	C18H22ClNO4	unknown
+COc1cc(CCNCc2cccc(O)c2OC)c(OC)cc1Cl	C18H22ClNO4	unknown
+COc1cc(CCNCc2c(O)cccc2OC)c(OC)cc1Cl	C18H22ClNO4	unknown
+CCOCO[C@H]1C[C@@H](C(=O)OC)[C@]2(C)CC[C@H]3C(=O)O[C@H](c4ccoc4)C[C@]3(C)[C@H]2C1=O	C24H32O8	unknown
+COC(=O)[C@@H]1C[C@H](OC2CCCCO2)C(=O)[C@H]2[C@@]1(C)CC[C@H]1C(=O)O[C@H](c3ccoc3)C[C@]21C	C26H34O8	unknown
+COC(=O)[C@@H]1C[C@H](OS(C)(=O)=O)C(=O)[C@H]2[C@@]1(C)CC[C@H]1C(=O)O[C@H](c3ccoc3)C[C@]21C	C22H28O9S	unknown
+COc1cc(CC/N=C/c2ccccc2OC)c(OC)cc1I	C18H20INO3	unknown
+COc1ccc(OC)c(CC/N=C/c2ccccc2OC)c1	C18H21NO3	unknown
+N#CC1(N2CCCCC2)CCCc2ccccc21	C16H20N2	arylcycloalkylamine
+O=Cc1ccc(OCc2ccccc2)c(OCc2ccccc2)c1	C21H18O3	unknown
+COc1cc(/C=C(\C)[N+](=O)[O-])ccc1O	C10H11NO4	unknown
+C/C(=C\c1ccc(OCc2ccccc2)c(OCc2ccccc2)c1)[N+](=O)[O-]	C23H21NO4	unknown
+CC(N)Cc1ccc(OCc2ccccc2)c(OCc2ccccc2)c1	C23H25NO2	unknown
+CNC(C)Cc1ccc(OCc2ccccc2)c(OCc2ccccc2)c1	C24H27NO2	unknown
+Oc1ccccc1O	C6H6O2	unknown
+O=Cc1ccc(O)c(O)c1	C7H6O3	unknown
+C=Cc1ccccc1	C8H8	unknown
+C/C=C/c1ccccc1	C9H10	unknown
+O=[N+]([O-])/C=C/c1ccc(O)c(O)c1	C8H7NO4	unknown
+C/C(=C\c1ccc(O)c(O)c1)[N+](=O)[O-]	C9H9NO4	unknown
+CC(NC(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1)c1ccccc1	C24H25N3O	unknown
+CCN(CC)C(=O)C1=CCCN(C)C1	C11H20N2O	unknown
+COC(=O)C1=CCC(CC2CNc3ccc(Br)cc32)N(C)C1	C17H21BrN2O2	unknown
+COC(=O)C1=CCC(C)N(C)C1	C9H15NO2	unknown
+COC(=O)C1=CC(c2ccccc2)C(C)N(C)C1	C15H19NO2	unknown
+CCN(CC)C(=O)C1C=C(c2ccccc2)CN(C)C1	C17H24N2O	unknown
+CCN(CC)C(=O)C1=CCC(Cc2c[nH]c3ccccc23)N(C)C1	C20H27N3O	unknown
+CN1Cc2ccccc2C(C(=O)O)C1	C11H13NO2	unknown
+CCN(CC)C(=O)C1CN(C)Cc2ccccc21	C15H22N2O	unknown
+CCN(CCC(=O)N(CC)CC)CCc1c[nH]c2ccccc12	C19H29N3O	tryptamine
+CCN(CC)C(=O)CCN(C)CCc1c[nH]c2ccccc12	C18H27N3O	tryptamine
+CC(CO)NC(=O)CCN(C)C1CCc2ccccc2C1	C17H26N2O2	unknown
+CCOC(=O)CCN(C)C1CCc2ccccc2C1	C16H23NO2	unknown
+CCCN(C)C1CCc2ccccc2C1	C14H21N	unknown
+CN1CC(C(=O)O)C=C2c3ccccc3CCC21	C15H17NO2	unknown
+CCN(CC)C(=O)C1C=C2c3ccccc3CCC2N(C)C1	C19H26N2O	unknown
+CCOC(=O)CCN(C)C(C)Cc1ccc(OC)cc1	C16H25NO3	unknown
+CCN(CC)C(=O)CN(C)C1CCc2ccccc2C1	C17H26N2O	unknown
+COc1ccc(Br)c(C=O)c1	C8H7BrO2	unknown
+COc1ccc(C=O)cc1Br	C8H7BrO2	unknown
+COc1cc(C=O)ccc1Br	C8H7BrO2	unknown
+COc1cc(Br)c(C=O)cc1OC	C9H9BrO3	unknown
+COc1cc(C=O)cc(OC)c1Br	C9H9BrO3	unknown
+COc1cc(C=O)c(OC)cc1Br	C9H9BrO3	unknown
+COc1ccc(Br)c(/C=C(\C)[N+](=O)[O-])c1	C10H10BrNO3	unknown
+COc1ccc(/C=C(\C)[N+](=O)[O-])cc1Br	C10H10BrNO3	unknown
+COc1cc(/C=C(\C)[N+](=O)[O-])ccc1Br	C10H10BrNO3	unknown
+COc1cc(Br)c(/C=C(\C)[N+](=O)[O-])cc1OC	C11H12BrNO4	unknown
+COc1cc(/C=C(\C)[N+](=O)[O-])cc(OC)c1Br	C11H12BrNO4	unknown
+COc1cc(/C=C(\C)[N+](=O)[O-])c(OC)cc1Br	C11H12BrNO4	unknown
+COC(=O)CCC(=O)c1cc(OC)c(C)cc1OC	C14H18O5	unknown
+COC(=O)CC(Br)C(=O)c1cc(OC)c(C)cc1OC	C14H17BrO5	unknown
+COC(=O)CC(C(=O)c1cc(OC)c(C)cc1OC)[N+](=O)[O-]	C14H17NO7	unknown
+COC(=O)CC(C(O)c1cc(OC)c(C)cc1OC)[N+](=O)[O-]	C14H19NO7	unknown
+COC(=O)CC(Cc1cc(OC)c(C)cc1OC)N(C)C(C)=O	C17H25NO5	unknown
+COc1cc(C)c(OC)c2c1C(=O)CCC2	C13H16O3	unknown
+COc1cc(C)c(OC)c(C=O)c1	C10H12O3	unknown
+COc1cc(C)c(OC)c(CO)c1	C10H14O3	unknown
+COc1cc(C)c(OC)c(/C=C/C(=O)O)c1	C12H14O4	unknown
+COc1cc(C)c(OC)c(CCC(=O)O)c1	C12H16O4	unknown
+COC(=O)CCCc1cc(OC)cc(C)c1OC	C14H20O4	unknown
+COc1cc(C)c(OC)c(CCCC(=O)O)c1	C13H18O4	unknown
+COc1cc(C)c(O)cc1C=O	C9H10O3	unknown
+COc1cc(CO)c(O)c(CO)c1	C9H12O4	unknown
+COc1cc(C)c(OC)c2c1C(=O)C(Br)CC2	C13H15BrO3	unknown
+COc1cc(C)c(OC)c2c1C(=O)C([N+](=O)[O-])CC2	C13H15NO5	unknown
+COc1cc(C(C)=O)c(OC)cc1C	C11H14O3	unknown
+COc1cc(C(=O)CBr)c(OC)cc1C	C11H13BrO3	unknown
+CN(CC(=O)c1ccccc1)CC1(C)OCCO1	C14H19NO3	beta-ketone
+COc1cc(C(=O)CN(C)CC2(C)OCCO2)c(OC)cc1C	C17H25NO5	beta-ketone
+CCOC(=O)C1CN(C)CC(OCC)(OCC)C1	C13H25NO4	unknown
+CCCCCCOC(=O)C1CN(C)CC(OCC)(OCC)C1	C17H33NO4	unknown
+CCOC(=O)CC1CN(C)CC1=O	C9H15NO3	unknown
+CN1CC(O)C(CCO)C1	C7H15NO2	unknown
+CCCCCCOC(=O)CC1CN(C)CC1=O	C13H23NO3	unknown
+CSc1ccc(/C=C(\C)[N+](=O)[O-])cc1	C10H11NO2S	unknown
+NC(=O)OC[C@H](N)Cc1ccccc1	C10H14N2O2	unknown
+CCC(NC)C(=O)c1cccc(C)c1	C12H17NO	beta-ketone
+CCCCCc1cc(O)c(C/C=C(\C)CCC=C(C)C)c(OC)c1	C22H34O2	cannabinoid
+O=CCc1ccccc1	C8H8O	unknown
+O=CCc1ccc(O)cc1	C8H8O2	unknown
+O=C(O)Cc1ccc(O)cc1	C8H8O3	unknown
+O=CC(O)c1ccc(O)cc1	C8H8O3	unknown
+O=C(O)C(O)c1ccc(O)cc1	C8H8O4	unknown
+O=CCc1ccc(O)c(O)c1	C8H8O3	unknown
+O=C(O)Cc1ccc(O)c(O)c1	C8H8O4	unknown
+O=CC(O)c1ccc(O)c(O)c1	C8H8O4	unknown
+O=C(O)C(O)c1ccc(O)c(O)c1	C8H8O5	unknown
+CC(Cc1ccc(F)cc1)NO	C9H12FNO	unknown
+c1cc(CN2CCNCC2)cs1	C9H14N2S	unknown
+CN(C)CCc1c([C@H]2c3ccc(O)cc3O[C@H](c3cc(O)c(O)c(O)c3)[C@H]2O)[nH]c2ccccc12	C27H28N2O6	unknown
+CN(C)[C@]1(c2ccc(Br)cc2)CC[C@](O)(CCc2cccs2)CC1	C20H26BrNOS	arylcycloalkylamine
+CCCCC(NC(C)C)C(=O)c1ccccc1	C15H23NO	beta-ketone
+CNC(C)C(=O)c1ccc(F)c(C)c1	C11H14FNO	beta-ketone
+CC(C)CCCC(C)N	C8H19N	unknown
+Cc1cccc(CCN2CCC(N(C(=O)C(C)C)c3ccc(F)cc3)CC2)c1	C24H31FN2O	fentanyl
+COC(=O)[C@@H](NC(=O)c1nn(CCCCCCl)c2ccccc12)C(C)(C)C	C20H28ClN3O3	cannabinoid
+CC(C)CC(C(=O)c1ccc(F)cc1)N1CCCC1	C16H22FNO	beta-ketone
+CCNC(CC(C)C)C(=O)c1ccccc1	C14H21NO	beta-ketone
+CCCNC(CCC)C(=O)c1ccccc1	C14H21NO	beta-ketone
+COC(=O)[C@@H](NC(=O)c1cn(CCCCCF)c2cccnc12)C(C)(C)C	C20H28FN3O3	cannabinoid
+CCNC(C)C(=O)c1ccc(Cl)c(Cl)c1	C11H13Cl2NO	beta-ketone
+c1ccc(CC(Cc2ccccc2)N2CCCC2)cc1	C19H23N	unknown
+CC(C(=O)c1ccc(Cl)c(Cl)c1)N(C)C1CCCCC1	C16H21Cl2NO	beta-ketone
+O=C(c1ccccc1)N(c1ccccc1)C1CCN(Cc2ccccc2)CC1	C25H26N2O	unknown
+CN1CCCCC(n2cc(C(=O)c3ccccc3I)c3ccccc32)C1	C22H23IN2O	cannabinoid
+CCC(C(=O)c1ccccc1)N(C)C	C12H17NO	beta-ketone
+CCCC(C(=O)c1ccccc1)N(C)C	C13H19NO	beta-ketone
+CCC(C(=O)c1ccccc1)N(CC)CC	C14H21NO	beta-ketone
+CCCC(C(=O)c1ccccc1)N(CC)CC	C15H23NO	beta-ketone
+NC1(c2ccccc2Cl)CCC=CC1=O	C12H12ClNO	arylcycloalkylamine
+NC1(c2ccccc2Cl)CC(O)CCC1=O	C12H14ClNO2	arylcycloalkylamine
+CNC1(c2ccccc2Cl)CCCC(O)C1=O	C13H16ClNO2	arylcycloalkylamine
+CC(C)C[C@H](CN)CC(=O)O	C8H17NO2	unknown
+CCC(C)ON=O	C4H9NO2	unknown
+ClCCCN1CCN(c2cccc(Cl)c2)CC1	C13H18Cl2N2	unknown
+COc1cc2c(cc1OC)-c1c(OC)c(OC)cc3c1C(C2)N(C)CC3	C21H25NO4	unknown
+CCC(C)CON=O	C5H11NO2	unknown
+COc1ccc(/C=C/[N+](=O)[O-])cc1O	C9H9NO4	unknown
+COc1ccc(/C=C(\C)[N+](=O)[O-])cc1O	C10H11NO4	unknown
+COc1cc(/C=C/[N+](=O)[O-])ccc1O	C9H9NO4	unknown
+CC1CCC(=O)O1	C5H8O2	unknown
+COc1cc(CCNC(C)=O)c(OC)cc1Br	C12H16BrNO3	unknown
+COc1cc(C=O)cc(OC)c1OCCF	C11H13FO4	unknown
+COc1cc(C=O)cc(OC)c1OCC(F)F	C11H12F2O4	unknown
+COc1cc(C=O)cc(OC)c1OCC(F)(F)F	C11H11F3O4	unknown
+COc1cc(C=O)cc(OC)c1OCCCF	C12H15FO4	unknown
+COc1cc(C=O)cc(OC)c1OCC(C)C	C13H18O4	unknown
+CCCOc1c(OC)cc(C=O)cc1OC	C12H16O4	unknown
+C=CCOc1c(OC)cc(C=O)cc1OC	C12H14O4	unknown
+COc1cc(C=O)cc(OC)c1OC(C)C	C12H16O4	unknown
+C=C(C)COc1c(OC)cc(C=O)cc1OC	C13H16O4	unknown
+COc1cc(/C=C/[N+](=O)[O-])cc(OC)c1OCCF	C12H14FNO5	unknown
+COc1cc(/C=C/[N+](=O)[O-])cc(OC)c1OCC(F)F	C12H13F2NO5	unknown
+COc1cc(/C=C/[N+](=O)[O-])cc(OC)c1OCC(F)(F)F	C12H12F3NO5	unknown
+COc1cc(/C=C/[N+](=O)[O-])cc(OC)c1OCCCF	C13H16FNO5	unknown
+COc1cc(/C=C/[N+](=O)[O-])cc(OC)c1OCC(C)C	C14H19NO5	unknown
+COc1cc(/C=C(\C)[N+](=O)[O-])cc(OC)c1OCCF	C13H16FNO5	unknown
+COc1cc(/C=C(\C)[N+](=O)[O-])cc(OC)c1OCC(F)F	C13H15F2NO5	unknown
+COc1cc(/C=C(\C)[N+](=O)[O-])cc(OC)c1OCC(F)(F)F	C13H14F3NO5	unknown
+COc1cc(/C=C(\C)[N+](=O)[O-])cc(OC)c1OCCCF	C14H18FNO5	unknown
+COc1cc(/C=C(\C)[N+](=O)[O-])cc(OC)c1OCC(C)C	C15H21NO5	unknown
+CCCOc1c(OC)cc(/C=C(\C)[N+](=O)[O-])cc1OC	C14H19NO5	unknown
+C=CCOc1c(OC)cc(/C=C(\C)[N+](=O)[O-])cc1OC	C14H17NO5	unknown
+COc1cc(/C=C(\C)[N+](=O)[O-])cc(OC)c1OC(C)C	C14H19NO5	unknown
+C=C(C)COc1c(OC)cc(/C=C(\C)[N+](=O)[O-])cc1OC	C15H19NO5	unknown
+NCCn1c(=O)[nH]c2ccccc2c1=O	C10H11N3O2	unknown
+Clc1ccccc1C(Cc1ccccc1)N1CCCCC1	C19H22ClN	unknown
+CCCNC1(c2ccccc2)CCCCC1=O	C15H21NO	arylcycloalkylamine
+CCNC1(c2cccc(F)c2)CCCCC1=O	C14H18FNO	arylcycloalkylamine
+Cc1ccc(C(=O)C(C)N(C)CC2CC2)cc1	C15H21NO	beta-ketone
+C=CCN(C)C(C)C(=O)c1ccc(C)cc1	C14H19NO	beta-ketone
+Cc1ccc(C(=O)C(C)N(C)C(=O)C(F)(F)F)cc1	C13H14F3NO2	beta-ketone
+Cc1ccc(C(=O)C(C)N(C)C(=O)C(F)(F)C(F)(F)F)cc1	C14H14F5NO2	beta-ketone
+Cc1ccc(C(=O)C(C)N(C)C(=O)C(F)(F)C(F)(F)C(F)(F)F)cc1	C15H14F7NO2	beta-ketone
+Cc1ccc(C(=O)C(C)N(C)C=O)cc1	C12H15NO2	beta-ketone
+CCC(=O)N(C)C(C)C(=O)c1ccc(C)cc1	C14H19NO2	beta-ketone
+CCC(C(=O)c1ccc2c(c1)OCO2)N(C)CC1CC1	C16H21NO3	beta-ketone
+C=CCN(C)C(CC)C(=O)c1ccc2c(c1)OCO2	C15H19NO3	beta-ketone
+CCC(C(=O)c1ccc2c(c1)OCO2)N(C)C(C)=O	C14H17NO4	beta-ketone
+CCC(C(=O)c1ccc2c(c1)OCO2)N(C)C(=O)C(F)(F)F	C14H14F3NO4	beta-ketone
+CCC(C(=O)c1ccc2c(c1)OCO2)N(C)C(=O)C(F)(F)C(F)(F)F	C15H14F5NO4	beta-ketone
+CCC(C(=O)c1ccc2c(c1)OCO2)N(C)C(=O)C(F)(F)C(F)(F)C(F)(F)F	C16H14F7NO4	beta-ketone
+CCC(C(=O)c1ccc2c(c1)OCO2)N(C)C=O	C13H15NO4	beta-ketone
+CCC(=O)N(C)C(CC)C(=O)c1ccc2c(c1)OCO2	C15H19NO4	beta-ketone
+CC(C(=O)c1ccc2c(c1)OCO2)N(C)CC1CC1	C15H19NO3	beta-ketone
+C=CCN(C)C(C)C(=O)c1ccc2c(c1)OCO2	C14H17NO3	beta-ketone
+CC(C(=O)c1ccc2c(c1)OCO2)N(C)C(=O)C(F)(F)F	C13H12F3NO4	beta-ketone
+CC(C(=O)c1ccc2c(c1)OCO2)N(C)C(=O)C(F)(F)C(F)(F)F	C14H12F5NO4	beta-ketone
+CC(C(=O)c1ccc2c(c1)OCO2)N(C)C(=O)C(F)(F)C(F)(F)C(F)(F)F	C15H12F7NO4	beta-ketone
+CC(C(=O)c1ccc2c(c1)OCO2)N(C)C=O	C12H13NO4	beta-ketone
+CCC(=O)N(C)C(C)C(=O)c1ccc2c(c1)OCO2	C14H17NO4	beta-ketone
+Cc1ccc(C(=O)C(C)N(C)[Si](C)(C)C)cc1	C14H23NOSi	beta-ketone
+CCC(C(=O)c1ccc2c(c1)OCO2)N(C)[Si](C)(C)C	C15H23NO3Si	beta-ketone
+CC(C(=O)c1ccc2c(c1)OCO2)N(C)[Si](C)(C)C	C14H21NO3Si	beta-ketone
+O=[N+]([O-])/C=C/c1cc(F)ccc1F	C8H5F2NO2	unknown
+C/C(=C\c1c2ccccc2cc2ccccc12)[N+](=O)[O-]	C17H13NO2	unknown
+CC(Cc1cc(F)ccc1F)NC(=O)C(F)(F)F	C11H10F5NO	unknown
+CC(Cc1cc(F)c(Br)cc1F)NC(=O)C(F)(F)F	C11H9BrF5NO	unknown
+CC(Cc1c2ccccc2cc2ccccc12)NC(=O)C(F)(F)F	C19H16F3NO	unknown
+CC(Cc1c2ccccc2c(Br)c2ccccc12)NC(=O)C(F)(F)F	C19H15BrF3NO	unknown
+Cc1c2c(cc3c1CCO3)OCC2	C11H12O2	unknown
+Cc1c2c(c(C=O)c3c1CCO3)OCC2	C12H12O3	unknown
+C/C(=C\c1c2c(c(C)c3c1OCC3)CCO2)[N+](=O)[O-]	C14H15NO4	unknown
+C/C(=C\c1c2occc2c(C)c2ccoc12)[N+](=O)[O-]	C14H11NO4	unknown
+CC(NC(=O)C(F)(F)F)C(=O)c1c2c(cc3c1OCC3)OCC2	C15H14F3NO4	beta-ketone
+CC(Cc1c2c(cc3c1OCC3)OCC2)NC(=O)C(F)(F)F	C15H16F3NO3	unknown
+CC(Cc1c2ccoc2cc2ccoc12)NC(=O)C(F)(F)F	C15H12F3NO3	unknown
+CC(Cc1c2c(c(Br)c3c1OCC3)OCC2)NC(=O)C(F)(F)F	C15H15BrF3NO3	unknown
+CC(Cc1c2c(c(C(F)(F)F)c3c1OCC3)OCC2)NC(=O)C(F)(F)F	C16H15F6NO3	unknown
+CC(Cc1c2ccoc2c(Br)c2ccoc12)NC(=O)C(F)(F)F	C15H11BrF3NO3	unknown
+CC(Cc1c2ccoc2c(C(F)(F)F)c2ccoc12)NC(=O)C(F)(F)F	C16H11F6NO3	unknown
+O=Cc1c2c(cc3c1OCC3)OCC2	C11H10O3	unknown
+O=[N+]([O-])/C=C/c1c2c(cc3c1OCC3)OCC2	C12H11NO4	unknown
+C/C(=C\c1c2c(cc3c1OCC3)OCC2)[N+](=O)[O-]	C13H13NO4	unknown
+Cc1c2c(c(C=O)c3c1OCC3)OCC2	C12H12O3	unknown
+C/C(=C\c1c2c(c(C)c3c1OCC3)OCC2)[N+](=O)[O-]	C14H15NO4	unknown
+Cc1c2c(cc3c1OCC3)OCC2	C11H12O2	unknown
+CC/C(=C\c1cccc2c1OCO2)[N+](=O)[O-]	C11H11NO4	unknown
+NS(=O)(=O)c1ccc(N2CCN(CC[C@@H]3OCCc4ccccc43)CC2)cc1	C21H27N3O3S	unknown
+CSc1ccc(C(C)(C)C)cc1	C11H16S	unknown
+NCCc1c[nH]c2ccc([N+](=O)[O-])cc12	C10H11N3O2	tryptamine
+CC(CCc1ccc2c(c1)OCO2)NN	C11H16N2O2	unknown
+Cc1ccc(N2CCN(Cc3nc4ccccc4[nH]3)CC2)cc1C	C20H24N4	unknown
+C=NC(C)Cc1ccc(C)cc1	C11H15N	unknown
+Cc1ccc(CC(C)N[Si](C)(C)C)cc1	C13H23NSi	unknown
+Cc1ccc(CC(C)NC(=O)C(F)(F)F)cc1	C12H14F3NO	unknown
+CC(=O)C(C#N)c1ccc(C)cc1	C11H11NO	unknown
+COc1cc(C=O)c(OC)cc1F	C9H9FO3	unknown
+COc1cc(/C=C(\C)[N+](=O)[O-])c(OC)cc1F	C11H12FNO4	unknown
+CNC(C)CC1=CCC=CC1	C10H17N	unknown
+CC(=O)N(C)C(C)CC1=CCC=CC1	C12H19NO	unknown
+CC(CC1=CCC=CC1)N(C)C(=O)[C@@H]1CCCN1C(=O)C(F)(F)F	C17H23F3N2O2	unknown
+COc1ccc(-c2cncnc2C)cc1	C12H12N2O	unknown
+CC1=C(CCO)C(C)(C)C[C@@H](O)C1=O	C11H18O3	unknown
+CN(C)c1ccc(CC(=O)O)cc1	C10H13NO2	unknown
+CCN(CC)C(=O)[C@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2NC1	C19H23N3O	unknown
+CC(Cc1c[nH]c2ccccc12)[N+](=O)[O-]	C11H12N2O2	unknown
+CC(Cc1c[nH]c2cccc(OCc3ccccc3)c12)[N+](=O)[O-]	C18H18N2O3	unknown
+CCC(Cc1c[nH]c2ccc(OC)cc12)[N+](=O)[O-]	C13H16N2O3	unknown
+c1ccc(COc2cccc3[nH]ccc23)cc1	C15H13NO	unknown
+CCNC(C)Cc1ccc2ccccc2c1	C15H19N	unknown
+CC1COC(c2cccc(Cl)c2)CN1	C11H14ClNO	unknown
+O=[N+]([O-])c1ccc(N2CCNCC2)cc1	C10H13N3O2	unknown
+FC(F)(F)c1cc(N2CCNCC2)ccc1Cl	C11H12ClF3N2	unknown
+CC(N)C#Cc1ccccc1	C10H11N	unknown
+COc1cc(CC(C)N)c(OC)cc1Cc1cccs1	C16H21NO2S	unknown
+COc1cc(C)c(OS(C)(=O)=O)cc1CC(C)N	C12H19NO4S	unknown
+COc1cc(CS(C)=O)c(OC)cc1CC(C)N	C13H21NO3S	unknown
+COc1cc(CC(C)NC(C)=O)c(OC)cc1C	C14H21NO3	unknown
+COc1cc(CC(C)=O)c(OC)cc1C	C12H16O3	unknown
+Cc1ccc(C(=O)c2cn(CCCCCBr)c3ccccc23)c2ccccc12	C25H24BrNO	cannabinoid
+O=C(c1cccc2ccccc12)c1cn(CCCC(O)CF)c2ccccc12	C24H22FNO2	cannabinoid
+CC(C)[C@H](NC(=O)c1nn(Cc2ccc(F)cc2)c2ccccc12)C(=O)O	C20H20FN3O3	cannabinoid
+CCCCCn1nc(C(=O)N[C@H](C(=O)O)C(C)C)c2ccccc21	C18H25N3O3	cannabinoid
+c1ccc2c(c1)cc1n2CCNC1	C11H12N2	unknown
+Clc1cccc2cc3n(c12)CCNC3	C11H11ClN2	unknown
+Clc1ccc2cc3n(c2c1)CCNC3	C11H11ClN2	unknown
+Clc1ccc2c(c1)cc1n2CCNC1	C11H11ClN2	unknown
+COc1cccc2cc3n(c12)CCNC3	C12H14N2O	unknown
+COc1ccc2cc3n(c2c1)CCNC3	C12H14N2O	unknown
+COc1ccc2c(c1)cc1n2CCNC1	C12H14N2O	unknown
+COc1c2n(c3ccc(Cl)cc13)CCNC2	C12H13ClN2O	unknown
+Cc1c2n(c3ccc(Cl)cc13)CCNC2	C12H13ClN2	unknown
+c1ccc2c(c1)nc1n2CCNC1	C10H11N3	unknown
+CN(C)CCn1ccc2cc(F)c(F)cc21	C12H14F2N2	unknown
+CC(N)Cn1ccc2cc(F)c(F)cc21	C11H12F2N2	unknown
+CC(N)Cn1ccc2ccccc21	C11H14N2	unknown
+C/N=C(\C)C(=O)c1cccc(F)c1	C10H10FNO	unknown
+CC(=O)N(C)C(C)C(=O)c1cccc(F)c1	C12H14FNO2	beta-ketone
+CC(C(=O)c1cccc(F)c1)N(C)C(=O)C(F)(F)F	C12H11F4NO2	beta-ketone
+CC(C(=O)c1cccc(F)c1)N(C)C(=O)C(F)(F)C(F)(F)F	C13H11F6NO2	beta-ketone
+CC(C(=O)c1cccc(F)c1)N(C)[Si](C)(C)C	C13H20FNOSi	beta-ketone
+CC(C(=O)c1cccc(F)c1)N(C)C(=O)O[Si](C)(C)C	C14H20FNO3Si	beta-ketone
+CNC1C2CCC(C2)C1c1c[nH]c2ccccc12	C16H20N2	tryptamine
+CN(C)C1C2CCC(C2)C1c1c[nH]c2ccccc12	C17H22N2	tryptamine
+COc1ccc2[nH]cc(C3C4CCC(C4)C3N(C)C)c2c1	C18H24N2O	tryptamine
+CC(C)NC1C2CCC(C2)C1c1c[nH]c2ccccc12	C18H24N2	tryptamine
+COc1ccc2[nH]cc(C3C4CCC(C4)C3NC(C)C)c2c1	C19H26N2O	tryptamine
+CC(C)N(C)C1C2CCC(C2)C1c1c[nH]c2ccccc12	C19H26N2	tryptamine
+COc1ccc2[nH]cc(C3C4CCC(C4)C3N(C)C(C)C)c2c1	C20H28N2O	tryptamine
+CCCN(CCC)C1C2CCC(C2)C1c1c[nH]c2ccccc12	C21H30N2	tryptamine
+O=c1ccc2[nH]cc(C3=CCNCC3)c2[nH]1	C12H13N3O	unknown
+O=C1CC2CCC1C(N1CCCCC1)C2c1c[nH]c2ccccc12	C21H26N2O	tryptamine
+COC(=O)[C@@H]1C2CCC(C[C@@H]1OC(=O)/C=C\c1ccccc1)N2C	C19H23NO4	unknown
+COC(=O)[C@@H]1C2CCC(C[C@@H]1OC(=O)/C=C/c1ccccc1)N2C	C19H23NO4	unknown
+COC(=O)[C@@H]1C[C@H](O)C(=O)[C@H]2[C@@]1(C)CC[C@H]1C(=O)O[C@H](c3ccoc3)C[C@]21C	C21H26O7	unknown
+COC(=O)C1=C[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]2[C@@]3(C)C[C@@H](c4ccoc4)OC(=O)[C@@H]3CC[C@@]12C	C25H30O9	unknown
+COC(=O)C1=C[C@H](O)[C@H](OC(C)=O)[C@@H]2[C@@]3(C)C[C@@H](c4ccoc4)OC(=O)[C@@H]3CC[C@@]12C	C23H28O8	unknown
+COC(=O)C1=C[C@H](OC(C)=O)[C@H](O)[C@@H]2[C@@]3(C)C[C@@H](c4ccoc4)OC(=O)[C@@H]3CC[C@@]12C	C23H28O8	unknown
+COC(=O)C1=CC[C@H](O)[C@@H]2[C@@]3(C)C[C@@H](c4ccoc4)OC(=O)[C@@H]3CC[C@@]12C	C21H26O6	unknown
+CC1CC[C@@]2(C)C(C(=O)O)=CC[C@H](O)[C@@H]2[C@@]1(C)CCc1ccoc1	C20H28O4	unknown
+COC(=O)C1=CC[C@H](O)[C@H]2[C@@]1(C)CCC(CO)[C@]2(C)CCc1ccoc1	C21H30O5	unknown
+CC(=O)OCC1CC[C@@]2(C)C(C(=O)O)=CCC[C@@H]2[C@@]1(C)CCc1ccoc1	C22H30O5	unknown
+CC1CC[C@@]2(C)C(C(=O)O)=CCC[C@@H]2[C@@]1(C)CCc1ccoc1	C20H28O3	unknown
+COC(=O)C1=CCC[C@H]2[C@@]1(C)CCC(C)[C@]2(C)CCc1ccoc1	C21H30O3	unknown
+COC(=O)C1=C[C@H](O)[C@H](O)[C@@H]2[C@@]3(C)C[C@@H](c4ccoc4)OC(=O)[C@@H]3CC[C@@]12C	C21H26O7	unknown
+COC(=O)C1=CC(=O)[C@H](OC(C)=O)[C@@H]2[C@@]3(C)C[C@@H](c4ccoc4)OC(=O)[C@@H]3CC[C@@]12C	C23H26O8	unknown
+COC(=O)C1=CC[C@H](O)[C@@H]2[C@@](C)(CCc3ccoc3)[C@H](COC(C)=O)CC[C@@]12C	C23H32O6	unknown
+COC(=O)C1=CC[C@H](O)[C@@H]2[C@@](C)(CCc3ccoc3)[C@H](C=O)CC[C@@]12C	C21H28O5	unknown
+COc1cc2c(cc1OC)C1Cc3ccc(OC)c(OC)c3CN1CC2	C21H25NO4	unknown
+COc1ccc2c(c1OC)CN1CCc3cc4c(cc3C1C2)OCO4	C20H21NO4	unknown
+CN1CC(O)C2=C/C(=N/NC(N)=O)C(=O)C=C21	C10H12N4O3	unknown
+CN(C)CCc1cn(Cc2ccccc2)c2cccc(O)c12	C19H22N2O	tryptamine
+CN(C)CCc1c[nH]c2cccc(OC(=O)Oc3ccccc3)c12	C19H20N2O3	tryptamine
+CCN(CC)CCN1c2ccccc2Sc2ccccc21	C18H22N2S	unknown
+Cn1ccc2cc(O)c(O)cc21	C9H9NO2	unknown
+COC(=O)[C@@H]1C[C@H](OC(C)=O)C(=O)[C@H]2[C@@]1(C)CC[C@H]1C(=O)O[C@H](c3ccoc3Br)C[C@]21C	C23H27BrO8	unknown
+COC(=O)[C@@H]1C[C@H](OC(C)=O)C(=O)[C@H]2[C@@]1(C)CC[C@H]1C(=O)O[C@H](c3ccoc3C)C[C@]21C	C24H30O8	unknown
+C#Cc1occc1[C@@H]1C[C@]2(C)[C@H]3C(=O)[C@@H](OC(C)=O)C[C@@H](C(=O)OC)[C@]3(C)CC[C@H]2C(=O)O1	C25H28O8	unknown
+CC[C@@H]1CN2CC[C@@]34OCCO[C@@]3(Nc3ccc(F)c(OC)c34)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC	C25H33FN2O6	unknown
+CC[C@@H]1CN2CC[C@]3(O)c4c(cccc4OC)NC3[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC	C23H32N2O5	unknown
+CC[C@@H]1CN2CC[C@]3(O)c4c(ccc(F)c4OC)NC3[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC	C23H31FN2O5	unknown
+C=C(C)CSc1cc(OC)c(C=O)cc1OC	C13H16O3S	unknown
+C=CCSc1cc(OC)c(C=O)cc1OC	C12H14O3S	unknown
+COc1cc(SCC(F)F)c(OC)cc1C=O	C11H12F2O3S	unknown
+COc1cc(SCC(F)(F)F)c(OC)cc1C=O	C11H11F3O3S	unknown
+COc1cc(SCC(C)C)c(OC)cc1C=O	C13H18O3S	unknown
+COc1cc(SCc2ccccc2)c(OC)cc1C=O	C16H16O3S	unknown
+COc1cc(SCCCF)c(OC)cc1C=O	C12H15FO3S	unknown
+COc1cc(SCCCCF)c(OC)cc1C=O	C13H17FO3S	unknown
+COc1cc(SCc2ccc(C(F)(F)F)cc2)c(OC)cc1C=O	C17H15F3O3S	unknown
+COc1cc(SCc2c(F)c(F)c(F)c(F)c2F)c(OC)cc1C=O	C16H11F5O3S	unknown
+COc1cccc(CSc2cc(OC)c(C=O)cc2OC)c1	C17H18O4S	unknown
+C=C(C)CSc1cc(OC)c(/C=C/[N+](=O)[O-])cc1OC	C14H17NO4S	unknown
+CCCCSc1cc(OC)c(/C=C/[N+](=O)[O-])cc1OC	C14H19NO4S	unknown
+COc1cc(SCC(F)F)c(OC)cc1/C=C/[N+](=O)[O-]	C12H13F2NO4S	unknown
+COc1cc(SCC(F)(F)F)c(OC)cc1/C=C/[N+](=O)[O-]	C12H12F3NO4S	unknown
+COc1cc(SCC(C)C)c(OC)cc1/C=C/[N+](=O)[O-]	C14H19NO4S	unknown
+COc1cc(SCc2ccccc2)c(OC)cc1/C=C/[N+](=O)[O-]	C17H17NO4S	unknown
+COc1cc(SCCCF)c(OC)cc1/C=C/[N+](=O)[O-]	C13H16FNO4S	unknown
+COc1cc(SCCCCF)c(OC)cc1/C=C/[N+](=O)[O-]	C14H18FNO4S	unknown
+COc1cc(SCc2ccc(C(F)(F)F)cc2)c(OC)cc1/C=C/[N+](=O)[O-]	C18H16F3NO4S	unknown
+COc1cc(SCc2c(F)c(F)c(F)c(F)c2F)c(OC)cc1/C=C/[N+](=O)[O-]	C17H12F5NO4S	unknown
+COc1cccc(CSc2cc(OC)c(/C=C/[N+](=O)[O-])cc2OC)c1	C18H19NO5S	unknown
+CCOc1ccc(OC)cc1C=O	C10H12O3	unknown
+CC(C)CSCn1cc(C(=O)c2cccc3ccccc23)c2ccccc21	C24H23NOS	cannabinoid
+NC(=O)c1ccc(F)c(Cn2cc(C(=O)c3cccc4ccccc34)c3ccccc32)c1	C27H19FN2O2	cannabinoid
+CN1CCCC[C@@H]1Cn1cc(C(=O)c2cccc3ccccc23)n2scnsn12	C21H23N5OS2	cannabinoid
+CN1CCCC[C@@H]1Cc1ccc(S(=O)(=O)O)c(C(=O)c2cccc3ccccc23)c1	C24H25NO4S	cannabinoid
+CN1CCCC[C@@H]1Cn1cc(S(=O)(=O)c2c[nH]c3ccccc23)c2ccccc21	C23H25N3O2S	cannabinoid
+Cc1ccc2nc(C)cc(C(=O)c3cn(C[C@H]4CCCCN4C)c4ccccc34)c2c1	C27H29N3O	cannabinoid
+CC1(C)C(C(=O)c2cn(CCSS(=O)(=O)O)c3ccccc23)C1(C)C	C18H23NO4S2	cannabinoid
+C#CCS(=O)(=O)CCCn1cc(C(=O)C2C(C)(C)C2(C)C)c2ccccc21	C22H27NO3S	cannabinoid
+CC1(C)C(C(=O)c2c(N)c(CCCC(F)(F)F)n3ccccc23)C1(C)C	C20H25F3N2O	cannabinoid
+Cc1c(C(=O)C2C(C)(C)C2(C)C)c2ccccn2c1CCCC(F)(F)F	C21H26F3NO	cannabinoid
+CCC(C#N)(CC)NC(=O)c1cn(CCCC(F)(F)F)c2ccccc12	C19H22F3N3O	cannabinoid
+O=C(Cc1cc[nH]c1)c1cn(CCCC(F)(F)F)c2ccccc12	C18H17F3N2O	cannabinoid
+O=C(c1cccc2ccccc12)c1cn(Cc2cccc3ncccc23)c2ccccc12	C29H20N2O	cannabinoid
+Cc1cc(C#N)ccc1Sn1cc(C(=O)c2cccc3ccccc23)c2ccccc21	C27H18N2OS	cannabinoid
+Cc1c(C(=O)c2cccc3ccccc23)c2ccccn2c1C[C@H]1CCCCN1C	C27H28N2O	cannabinoid
+CN1CCCC[C@@H]1Cc1cc(C(=O)c2cccc3ccccc23)c2cnsn12	C23H23N3OS	cannabinoid
+CN1CCCC[C@@H]1Cn1cc(C(=O)c2cc3ccccc3c3ccccc23)c2ccccc21	C30H28N2O	cannabinoid
+CN1CCCC[C@@H]1Cn1cc(C(=O)c2c/c(=N/N)[nH]c3ccccc23)c2ccccc21	C25H27N5O	cannabinoid
+CC1(C)C(C(=O)c2cn(Cc3ccc(C#N)cc3)c3ccccc23)C1(C)C	C24H24N2O	cannabinoid
+CC1(C)C(C(=O)c2cn(CC[C@H]3CCC(=O)N3)c3ccccc23)C1(C)C	C22H28N2O2	cannabinoid
+CC1(C)C(C(=O)c2cc(CCCC(F)(F)F)n3ccc(Cl)cc23)C1(C)C	C20H23ClF3NO	cannabinoid
+CC1(C)C(C(=O)c2cc(CCCC(F)(F)F)cc3c2OCCC3)C1(C)C	C21H27F3O2	cannabinoid
+Cn1cc(Cl)c(C(=O)c2cn(CCCC(F)(F)F)c3ccccc23)n1	C17H15ClF3N3O	cannabinoid
+FC(F)(F)CCCn1cc(-c2noc3cccc(Cl)c23)c2ccccc21	C19H14ClF3N2O	cannabinoid
+Oc1ccc(CCNCc2ccccc2)cc1	C15H17NO	unknown
+O=[N+]([O-])c1ccc(/C=N/CCc2ccc(O)cc2)cc1	C15H14N2O3	unknown
+O=[N+]([O-])c1cccc(/C=N/CCc2ccc(O)cc2)c1	C15H14N2O3	unknown
+Oc1ccc(CC/N=C/c2ccccc2)cc1	C15H15NO	unknown
+COc1ccc(/C=N/CCc2ccc(O)cc2)cc1	C16H17NO2	unknown
+COc1cc(/C=N/CCc2ccc(O)cc2)ccc1O	C16H17NO3	unknown
+Clc1ccc(N2CCNCC2)cc1Cl	C10H12Cl2N2	unknown
+CCC(C)(N)Cc1ccc(Cl)cc1	C11H16ClN	unknown
+CCCN(CCC)C1Cc2cc3c(cc2C1)OCO3	C16H23NO2	unknown
+CN1C2CCC1[C@@H](C(=O)N1CCCC1)[C@@H](c1ccc(Cl)cc1)C2	C19H25ClN2O	unknown
+CNCCC(Oc1ccccc1OC)c1ccccc1	C17H21NO2	unknown
+CNCCCC1c2ccccc2C=Cc2ccccc21	C19H21N	unknown
+CN1C2CCC1CC(OC(c1ccc(F)cc1)c1ccc(F)cc1)C2	C21H23F2NO	unknown
+NC1=NCC(c2cccc(C(F)(F)F)c2)O1	C10H9F3N2O	unknown
+NC1=NCC(c2ccc(Br)cc2)O1	C9H9BrN2O	unknown
+CC(C)CC1N=C(N)OC1c1ccccc1	C13H18N2O	unknown
+CC(C)(C)C1N=C(N)OC1c1ccccc1	C13H18N2O	unknown
+CC1N=C(N)OC1c1ccccc1F	C10H11FN2O	unknown
+COc1cc(Br)ccc1C=O	C8H7BrO2	unknown
+O=C(C1CC1)N(c1ccc(F)cc1)C1CCN(Cc2ccccc2)CC1	C22H25FN2O	fentanyl
+CCCC(C(=O)c1cccc(F)c1)N1CCCC1	C15H20FNO	beta-ketone
+COc1cc(CC(C)NCCn2cnc3c2c(=O)n(C)c(=O)n3C)c(OC)cc1Cl	C20H26ClN5O4	unknown
+CCNC(C)Cc1cccc2ccoc12	C13H17NO	unknown
+CC(C)(C)[C@H](NC(=O)c1nn(CC2CCC(O)CC2)c2ccccc12)C(N)=O	C21H30N4O3	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1nn(CC2CCCCC2)c2ccccc12)C(=O)O	C21H29N3O3	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1nn(CC2CCC(O)CC2)c2ccccc12)C(=O)O	C21H29N3O4	cannabinoid
+COC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc(N)cc1)N2C	C16H22N2O2	unknown
+COC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc([N+](=O)[O-])cc1)N2C	C16H20N2O4	unknown
+COC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc(O)cc1)N2C	C16H21NO3	unknown
+COC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc(C(F)(F)F)cc1)N2C	C17H20F3NO2	unknown
+C/C=C\c1ccc([C@H]2CC3CCC([C@H]2C(=O)OC)N3C)cc1	C19H25NO2	unknown
+C#Cc1ccc([C@H]2CC3CCC([C@H]2C(=O)OC)N3C)cc1	C18H21NO2	unknown
+CC#Cc1ccc([C@H]2CC3CCC([C@H]2C(=O)OC)N3C)cc1	C19H23NO2	unknown
+COC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc(-c3ccccc3)cc1)N2C	C22H25NO2	unknown
+COC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc3ccccc3c1)N2C	C20H23NO2	unknown
+COC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc(/C=C/c3ccccc3)cc1)N2C	C24H27NO2	unknown
+COC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc(C#Cc3ccccc3)cc1)N2C	C24H25NO2	unknown
+CCc1ccc([C@H]2CC3CCC(N3)[C@H]2C(=O)OC)cc1I	C17H22INO2	unknown
+COC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc(SC)cc1)N2C	C17H23NO2S	unknown
+CCOc1ccc([C@H]2CC3CCC([C@H]2C(=O)OC)N3C)cc1	C18H25NO3	unknown
+CCCc1ccc([C@H]2CC3CCC([C@H]2C(=O)OC)N3C)cc1	C19H27NO2	unknown
+CN1C2CCC1[C@@H](C(=O)OC1CC1)[C@@H](c1ccc(I)cc1)C2	C18H22INO2	unknown
+CC(C)OC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc(Cl)cc1)N2C	C18H24ClNO2	unknown
+CN1C2CCC1[C@@H](C(=O)OC1CC1)[C@@H](c1ccc(Cl)cc1)C2	C18H22ClNO2	unknown
+Cc1ccc([C@H]2CC3CCC([C@H]2C(=O)OC2CC2)N3C)cc1	C19H25NO2	unknown
+Cc1ccc([C@H]2CC3CCC([C@H]2C(=O)OC(C)C)N3C)cc1	C19H27NO2	unknown
+Cc1ccc([C@H]2CC3CCC([C@H]2C(=O)OC2CCC2)N3C)cc1	C20H27NO2	unknown
+Cc1ccc([C@H]2CC3CCC([C@H]2C(=O)Oc2ccccc2)N3C)cc1	C22H25NO2	unknown
+CN1C2CCC1[C@@H](CCCO)[C@@H](c1ccccc1)C2	C17H25NO	unknown
+CNC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc(Cl)cc1)N2C	C16H21ClN2O	unknown
+Cc1ccc([C@H]2CC3CCC([C@H]2C(=O)N2CCOCC2)N3C)cc1	C20H28N2O2	unknown
+CN(C)C(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc(Cl)cc1)N2C	C17H23ClN2O	unknown
+CON(C)C(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc(Cl)cc1)N2C	C17H23ClN2O2	unknown
+CON(C)C(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc(C)cc1)N2C	C18H26N2O2	unknown
+CN1C2CCC1[C@@H](C(=O)N1CCCO1)[C@@H](c1ccc(Cl)cc1)C2	C18H23ClN2O2	unknown
+Cc1noc([C@@H]2C3CCC(C[C@@H]2c2ccc(Cl)cc2)N3C)n1	C17H20ClN3O	unknown
+Cc1ccc([C@H]2CC3CCC([C@H]2c2nnc(C)o2)N3C)cc1	C18H23N3O	unknown
+CN1C2CCC1[C@@H](c1nc3ccccc3s1)[C@@H](c1ccc(Cl)cc1)C2	C21H21ClN2S	unknown
+Cc1ccc([C@H]2CC3CCC([C@H]2c2nc4ccccc4s2)N3C)cc1	C22H24N2S	unknown
+COC(=O)C[C@@H]1C2CCC(C[C@@H]1c1ccc(C)cc1)N2C	C18H25NO2	unknown
+Cc1ccc([C@H]2CC3CCC([C@H]2CN(C)C)N3C)cc1	C18H28N2	unknown
+Cc1ccc([C@H]2CC3CCC([C@H]2C(C)C)N3C)cc1	C18H27N	unknown
+Cc1ccc([C@H]2CC3CCC([C@H]2CCCO)N3C)cc1	C18H27NO	unknown
+COC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc(C)c(C)c1)N2C	C18H25NO2	unknown
+COC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc(Br)c(Br)c1)N2C	C16H19Br2NO2	unknown
+COC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc(I)c(I)c1)N2C	C16H19I2NO2	unknown
+COC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc(Br)c(Cl)c1)N2C	C16H19BrClNO2	unknown
+COC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc(I)c(Br)c1)N2C	C16H19BrINO2	unknown
+COC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc3c(c1)OCO3)N2C	C17H21NO4	unknown
+CCC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccccc1)N2C	C17H23NO	unknown
+CCC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc(C)cc1)N2C	C18H25NO	unknown
+CCC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc(F)cc1)N2C	C17H22FNO	unknown
+CCC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc3ccccc3c1)N2C	C21H25NO	unknown
+CCC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc(C(C)C)cc1)N2C	C20H29NO	unknown
+CCC(=O)[C@H]1C2CCC(C[C@@H]1c1ccc3cc(OC)ccc3c1)N2C	C22H27NO2	unknown
+CC(=O)O[C@@H]1C2CCC(C[C@@H]1OC(=O)c1ccccc1)N2C	C17H21NO4	unknown
+COC(=O)[C@@H]1C2CCC(C[C@@H]1C(=O)Oc1ccccc1)N2C	C17H21NO4	unknown
+CC(=O)O[C@@H]1C2CCC(C[C@@H]1C(=O)Oc1ccccc1)N2C	C17H21NO4	unknown
+CCOC(=O)[C@@H]1C2CCC(C[C@@H]1OC(=O)c1ccccc1)N2C	C18H23NO4	unknown
+CCCOC(=O)[C@@H]1C2CCC(C[C@@H]1OC(=O)c1ccccc1)N2C	C19H25NO4	unknown
+CC(C)OC(=O)[C@@H]1C2CCC(C[C@@H]1OC(=O)c1ccccc1)N2C	C19H25NO4	unknown
+CN1C2CCC1[C@@H](C(=O)Oc1ccccc1)[C@@H](c1ccc(Cl)cc1)C2	C21H22ClNO2	unknown
+Clc1ccc([C@@H]2CC3CCC(N3)[C@H]2COc2ccc3c(c2)OCO3)cc1	C21H22ClNO3	unknown
+COC[C@H]1C2CCC(C[C@@H]1c1ccc(Cl)c(Cl)c1)N2	C15H19Cl2NO	unknown
+CCOC[C@H]1C2CCC(C[C@@H]1c1ccc(Cl)c(Cl)c1)N2C	C17H23Cl2NO	unknown
+CO/N=C/[C@H]1C2CCC(C[C@@H]1c1ccc(Cl)c(Cl)c1)N2C	C16H20Cl2N2O	unknown
+COC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc(F)cc1)N2C/C=C/I	C18H21FINO2	unknown
+COC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc(I)cc1)N2CCCF	C18H23FINO2	unknown
+FCCCN1C2CCC1[C@@H](c1cc(-c3ccccc3)no1)[C@@H](c1ccc(Cl)cc1)C2	C25H26ClFN2O	unknown
+COC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc(Cl)c(Cl)c1)O2	C15H16Cl2O3	unknown
+COC(=O)[C@H]1CN(C)CC[C@@H]1c1ccc(Cl)cc1	C14H18ClNO2	unknown
+COC(=O)[C@@H]1CN(C)CC[C@@H]1c1ccc(Cl)c(Cl)c1	C14H17Cl2NO2	unknown
+COC(=O)[C@@H]1CN(C)CC[C@@H]1c1ccc2ccccc2c1	C18H21NO2	unknown
+CC(C)NC(=O)CSC[C@H]1CN(C)CC[C@@H]1c1ccc(Cl)cc1	C18H27ClN2OS	unknown
+COC(=O)[C@@H]1C2CCC(C[C@@H]1OC(=O)c1ccccc1)N2	C16H19NO4	unknown
+COC(=O)[C@@H]1C2CCC(C[C@H]1OC(c1ccc(F)cc1)c1ccc(F)cc1)N2C	C23H25F2NO3	unknown
+COC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc(Cl)nc1)N2C	C15H19ClN2O2	unknown
+Cc1ccc([C@]23CNC[C@H]2C3)cc1	C12H15N	unknown
+COC[C@]12CNCC[C@@]1(c1ccc(Cl)c(Cl)c1)C2	C14H17Cl2NO	unknown
+CCCC[C@@H]1[C@H](c2ccc(C)cc2)C2CCN1CC2	C18H27N	unknown
+COC(=O)[C@@H]1C2CCC(C[C@@H]1OC(=O)c1ccccc1O)N2C	C17H21NO5	unknown
+COC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc(Br)cc1)N2C	C16H20BrNO2	unknown
+COC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc(OC)cc1)N2C	C17H23NO3	unknown
+COC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc(-c3ccsc3)cc1)N2C	C20H23NO2S	unknown
+CN1C2CCC1[C@@H](C(=O)N1CCOCC1)[C@@H](c1ccc(Cl)cc1)C2	C19H25ClN2O2	unknown
+CN1C2CCC1[C@@H](C(=O)N1CCCC1)[C@@H](c1ccc(I)cc1)C2	C19H25IN2O	unknown
+CN1C2CCC1[C@@H](C(=O)N1CCCO1)[C@@H](c1ccc(I)cc1)C2	C18H23IN2O2	unknown
+Cc1ccc([C@H]2CC3CCC([C@H]2c2cc(C)no2)N3C)cc1	C19H24N2O	unknown
+CN1C2CCC1[C@@H](c1cc(-c3ccccc3)no1)[C@@H](c1ccc(Cl)cc1)C2	C23H23ClN2O	unknown
+Cc1ccc([C@H]2CC3CCC([C@H]2c2cc(-c4ccccc4)no2)N3C)cc1	C24H26N2O	unknown
+CCc1cc([C@@H]2C3CCC(C[C@@H]2c2ccc(C)cc2)N3C)on1	C20H26N2O	unknown
+Cc1ccc(-c2cc([C@@H]3C4CCC(C[C@@H]3c3ccc(Cl)cc3)N4C)on2)cc1	C24H25ClN2O	unknown
+COc1ccc(-c2cc([C@@H]3C4CCC(C[C@@H]3c3ccc(C)cc3)N4C)on2)cc1	C25H28N2O2	unknown
+Cc1ccc([C@H]2CC3CCC([C@H]2c2cc(-c4ccc(F)cc4)no2)N3C)cc1	C24H25FN2O	unknown
+Cc1ccc([C@H]2CC3CCC([C@H]2c2cc(-c4ccc(Cl)cc4)no2)N3C)cc1	C24H25ClN2O	cannabinoid
+Cc1ccc([C@H]2CC3CCC([C@H]2c2nc(-c4ccccc4)no2)N3C)cc1	C23H25N3O	unknown
+Cc1noc([C@@H]2C3CCC(C[C@@H]2c2ccccc2)N3C)n1	C17H21N3O	unknown
+CC(C)[C@@H]1C2CCC(C[C@@H]1c1ccc(Cl)cc1)N2C	C17H24ClN	unknown
+CCC[C@@H]1C2CCC(C[C@@H]1c1ccc(C)cc1)N2C	C18H27N	unknown
+CN1C2CCC1[C@@H](c1ccccc1)[C@@H](c1ccccc1)C2	C20H23N	unknown
+COC[C@@H]1C2CCC(C[C@@H]1c1ccc(C)cc1)N2C	C17H25NO	unknown
+COC(=O)[C@@H]1CN(C)CC[C@@H]1c1ccc(Cl)cc1	C14H18ClNO2	unknown
+COC(=O)[C@@H](NC(=O)c1nn(CCCCC#N)c2ccccc12)C(C)(C)C	C20H26N4O3	cannabinoid
+COC(=O)[C@@H](NC(=O)c1nn(CCCCF)c2ccccc12)C(C)(C)C	C19H26FN3O3	cannabinoid
+C=CCCCn1cc(C(=O)N[C@H](C(=O)OC)C(C)C)c2ccccc21	C20H26N2O3	cannabinoid
+CCCC(=O)N1CCN(C/C=C/c2ccccc2)CC1	C17H24N2O	unknown
+CCCC(=O)N1CCN(C/C=C/c2ccccc2)CC1C	C18H26N2O	unknown
+CCC(=O)N1C2CCC1CN(C/C=C/c1ccccc1)C2	C18H24N2O	unknown
+CN(C)C[C@@H]1CCCC[C@H]1c1cccc(O)c1	C15H23NO	unknown
+CN(C)[C@@H](c1cccc(O)c1)[C@H]1CCCC[C@H]1O	C15H23NO2	unknown
+CCCC1(c2cccc(O)c2)CCN(C)C1	C14H21NO	unknown
+COc1ccccc1C1CC1C(=O)O	C11H12O3	unknown
+COc1ccccc1C1CC1N	C10H13NO	unknown
+COc1ccccc1C1CC1N(C)C	C12H17NO	unknown
+CCN(CC)C1CC1c1ccccc1OC	C14H21NO	unknown
+CCCCN(CCCC)C1CC1c1ccccc1OC	C18H29NO	unknown
+COc1cccc(C2CC2C(=O)O)c1	C11H12O3	unknown
+COc1cccc(C2CC2N)c1	C10H13NO	unknown
+COc1cccc(C2CC2N(C)C)c1	C12H17NO	unknown
+CCN(CC)C1CC1c1cccc(OC)c1	C14H21NO	unknown
+CCCCN(CCCC)C1CC1c1cccc(OC)c1	C18H29NO	unknown
+COc1ccc(C2CC2C(=O)O)cc1	C11H12O3	unknown
+CCCN(CCC)C1CC1c1ccc(OC)cc1	C16H25NO	unknown
+COc1ccc(C2CC2C(=O)O)cc1OC	C12H14O4	unknown
+CCCN(CCC)C1CC1c1ccc(OC)c(OC)c1	C17H27NO2	unknown
+CC1(N)CCc2cc(O)c(O)cc2C1	C11H15NO2	unknown
+COCC[C@H]1C[C@H]2CN3CCc4c([nH]c5ccccc45)[C@](C(=O)OC)(C2)[C@H]13	C22H28N2O3	unknown
+COC(=O)[C@@H]1C2CCC(C[C@@H]1OC(=O)c1ccccc1)N2S(C)(=O)=O	C17H21NO6S	unknown
+COC(=O)[C@@H]1C2CCC(C[C@@H]1OC(=O)c1ccccc1)O2	C16H18O5	unknown
+COC(=O)[C@@H]1C2CCC(C2)C[C@@H]1OC(=O)c1ccccc1	C17H20O4	unknown
+COC(=O)[C@H]1C2CCC(C[C@@H]1OC(=O)c1ccccc1)N2C	C17H21NO4	unknown
+CN1C2CCC1[C@@H](C(=O)Oc1ccccc1)[C@@H](OC(=O)c1ccccc1)C2	C22H23NO4	unknown
+CCOC(=O)c1cc([C@@H]2C3CCC(C[C@@H]2c2ccc(Cl)cc2)N3C)no1	C20H23ClN2O3	unknown
+CN1C2CCC1[C@@H](c1nc(-c3ccccc3)no1)[C@@H](c1ccc(Cl)cc1)C2	C22H22ClN3O	unknown
+COC(=O)[C@@H]1C2CCC(C[C@H]1OC(=O)c1ccccc1)N2C	C17H21NO4	unknown
+CCOC(=O)[C@@H]1C2CCC(C[C@@H]1c1cccc3ccccc13)N2C	C21H25NO2	unknown
+CCOC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc3ccccc3c1)N2C	C21H25NO2	unknown
+CN1C(=O)C(O)N=C(c2ccccc2)c2cc([N+](=O)[O-])ccc21	C16H13N3O4	aryldiazepine
+CN1C(=O)C(O)N=C(c2ccccc2F)c2cc([N+](=O)[O-])ccc21	C16H12FN3O4	aryldiazepine
+Nc1ccc2c(c1)C(c1ccccc1F)=NCC(=O)N2	C15H12FN3O	aryldiazepine
+Cc1nnc2n1-c1ccc(Br)cc1C(c1ccccc1F)=NC2O	C17H12BrFN4O	aryldiazepine
+OCc1nnc2n1-c1ccc(Br)cc1C(c1ccccc1F)=NC2	C17H12BrFN4O	aryldiazepine
+OCc1nnc2n1-c1ccc(Br)cc1C(c1ccccc1F)=NC2O	C17H12BrFN4O2	aryldiazepine
+O=c1[nH]nc(CS(=O)C(c2ccccc2)c2ccccc2)s1	C16H14N2O2S2	unknown
+COC1NN=C(CS(=O)C(c2ccccc2)c2ccccc2)S1	C17H18N2O2S2	unknown
+Cc1nnc(CS(=O)C(c2ccccc2)c2ccccc2)s1	C17H16N2OS2	unknown
+O=S(Cc1nc(C(F)(F)F)no1)C(c1ccccc1)c1ccccc1	C17H13F3N2O2S	unknown
+CC(C)c1nnsc1CS(=O)C(c1ccccc1)c1ccccc1	C19H20N2OS2	unknown
+COc1ccnc(CS(=O)C(c2ccccc2)c2ccccc2)c1OC	C21H21NO3S	unknown
+O=S(Cc1ccncc1)C(c1ccccc1)c1ccccc1	C19H17NOS	unknown
+Cc1noc(CS(=O)C(c2ccccc2)c2ccccc2)n1	C17H16N2O2S	unknown
+Cc1nc(O)cc(CS(=O)C(c2ccccc2)c2ccccc2)n1	C19H18N2O2S	unknown
+O=S(Cc1cc(C2CC2)on1)C(c1ccccc1)c1ccccc1	C20H19NO2S	unknown
+O=S(Cc1nc(O)cc(C(F)(F)F)n1)C(c1ccccc1)c1ccccc1	C19H15F3N2O2S	unknown
+Cc1cc(O)nc(CS(=O)C(c2ccccc2)c2ccccc2)n1	C19H18N2O2S	unknown
+COc1cc(C)nc(CS(=O)C(c2ccccc2)c2ccccc2)n1	C20H20N2O2S	unknown
+Cc1cc(CS(=O)C(c2ccccc2)c2ccccc2)nc(C)n1	C20H20N2OS	unknown
+Cc1cnc(CS(=O)C(c2ccccc2)c2ccccc2)nc1	C19H18N2OS	unknown
+O=S(Cc1ccsc1)C(c1ccccc1)c1ccccc1	C18H16OS2	unknown
+O=S(Cc1ccsc1Br)C(c1ccccc1)c1ccccc1	C18H15BrOS2	unknown
+O=S(Cc1sccc1Cl)C(c1ccccc1)c1ccccc1	C18H15ClOS2	unknown
+Cc1scc(CS(=O)C(c2ccccc2)c2ccccc2)c1C	C20H20OS2	unknown
+O=S(Cc1csc(Br)c1)C(c1ccccc1)c1ccccc1	C18H15BrOS2	unknown
+O=S(Cc1ccc(Cl)s1)C(c1ccccc1)c1ccccc1	C18H15ClOS2	unknown
+O=S(Cc1cc(Br)cs1)C(c1ccccc1)c1ccccc1	C18H15BrOS2	unknown
+O=S(Cc1cccs1)C(c1ccc(Cl)cc1)c1ccc(Cl)cc1	C18H14Cl2OS2	unknown
+O=S(Cc1cccs1)C(c1ccccc1)c1ccccc1	C18H16OS2	unknown
+Cc1ccc(C(c2ccccc2)S(=O)Cc2cccs2)cc1	C19H18OS2	unknown
+O=S(Cc1cccs1)C(c1ccccc1)c1ccc(Br)cc1	C18H15BrOS2	unknown
+O=S(Cc1cccs1)C(c1ccc(F)cc1)c1ccc(F)cc1	C18H14F2OS2	unknown
+Cc1ccc(C(c2ccc(C)cc2)S(=O)Cc2cccs2)cc1	C20H20OS2	unknown
+COC1=C(OC)C(=O)C(CCCCCCCCCCO)=C(C)C1=O	C19H30O5	unknown
+Nc1c2c(nc3ccccc13)CCCC2	C13H14N2	unknown
+COc1cc2c(cc1OC)C(=O)C(CC1CCN(Cc3ccccc3)CC1)C2	C24H29NO3	unknown
+COc1ccc2c3c1O[C@H]1C[C@@H](O)C=C[C@@]31CCN(C)C2	C17H21NO3	unknown
+O=C(c1ccc(OCCCc2c[nH]cn2)cc1)C1CC1	C16H18N2O2	unknown
+Cc1cc([C@H]2CCCN2C)on1	C9H14N2O	unknown
+CNC(=O)c1ccc(Oc2ccc3c(c2)CCN(C2CCC2)CC3)nc1	C21H25N3O2	unknown
+O=C(c1ccc2c(c1)OCCO2)N1CCCCC1	C14H17NO3	unknown
+COc1ccc(NS(=O)(=O)c2sc3ccc(Cl)cc3c2C)cc1N1CCNCC1	C20H22ClN3O3S2	unknown
+O=C(Nc1cc(Cl)ccc1O)Nc1cc(C(F)(F)F)ccc1Cl	C14H9Cl2F3N2O2	unknown
+CNC(=O)Oc1ccc2c(c1)[C@]1(C)CCN(C)[C@@H]1N2C	C15H21N3O2	unknown
+C/C=C1\[C@H]2C=C(C)C[C@]1(N)c1ccc(=O)[nH]c1C2	C15H18N2O	unknown
+CN1CC[C@@]2(C)c3cc(OC(=O)Nc4ccccc4)ccc3N(C)[C@@H]12	C20H23N3O2	unknown
+CCCCCCOc1nsnc1C1=CCCN(C)C1	C14H23N3OS	unknown
+C[C@@H]1O[C@@]2(CS1)CN1CCC2CC1	C10H17NOS	unknown
+CCn1nnc(C2=CCCN(C)C2)n1	C9H15N5	unknown
+CC[C@@H]1SC2(CCN(C)CC2)NC1=O	C10H18N2OS	unknown
+CC1=C(C(=O)OC2CCCC2)C(c2cc3c(cc2[N+](=O)[O-])OCO3)NC(=O)N1C	C19H21N3O7	unknown
+CCOc1ccc(NCC(=O)N/N=C/c2c(O)ccc3ccccc23)cc1	C21H21N3O3	unknown
+CN1CCC[C@H]1c1cccnc1	C10H14N2	unknown
+CN1CC2CN(c3ccc(-c4ccccc4)nn3)CC2C1	C17H20N4	unknown
+O=C(Oc1ccc(Br)cc1)N1CCN2CCC1CC2	C14H17BrN2O2	unknown
+O=C(N[C@@H]1C2CCN(CC2)[C@H]1Cc1cccnc1)c1cc2ccccc2o1	C22H23N3O2	unknown
+C[C@H](OC(=O)N[C@@H]1CN2CCC1CC2)c1ccccc1F	C16H21FN2O2	unknown
+c1cnc2cc3c(cc2n1)[C@@H]1CNC[C@H]3C1	C13H13N3	unknown
+CN[C@@H](C)C/C=C/c1cncc(OC(C)C)c1	C14H22N2O	unknown
+Cc1ncccc1OC[C@H]1CCCN1	C11H16N2O	unknown
+Clc1cc(N2C[C@@H]3CN[C@@H]3C2)cnc1Cl	C10H11Cl2N3	unknown
+C[C@@H]1CCCN1CCc1cc2cc(-c3ccc(C#N)cc3)ccc2o1	C22H22N2O	unknown
+Clc1ccc(CCCOCCCN2CCCCC2)cc1	C17H26ClNO	unknown
+Cc1nc2cccc(C(F)(F)F)c2c(=O)n1-c1ccc(OC2CCN(C3CCC3)CC2)cc1	C25H26F3N3O2	unknown
+C[C@H](CN(C(=O)c1ccc(C#N)cc1)c1ccccn1)N1CCN(c2cccc3c2OCCO3)CC1	C28H29N5O3	unknown
+COc1cc(N)c(Cl)cc1C(=O)CCCCN1CCCCC1	C17H25ClN2O2	unknown
+Nc1c(Cl)cc(-c2nn(C3CCN(CCc4ccccc4)CC3)c(=O)o2)c2c1OCCO2	C23H25ClN4O4	unknown
+COc1cc(Cl)cc(C(C)Nc2cc(N3CCNCC3)ccc2S(C)(=O)=O)c1OC	C21H28ClN3O4S	unknown
+O=S(=O)(c1ccccc1)c1cnc2c(N3CCNCC3)cccc2c1	C19H19N3O2S	unknown
+Cc1ccc2c(c1)c1c(n2CCc2ccc(C)nc2)CCN(C)C1	C21H25N3	unknown
+Cc1cccc(S(=O)(=O)N(C)[C@H](C)CCN2CCC(C)CC2)c1	C18H30N2O2S	unknown
+CC1CCN(CC[C@@H]2CCCN2S(=O)(=O)c2cccc(O)c2)CC1	C18H28N2O3S	unknown
+O=S(=O)(c1ccc2cc[nH]c2c1)N1CCC[C@H]1CCN1CCC(Oc2ccc(Cl)cc2)CC1	C25H30ClN3O3S	unknown
+NC[C@@H]1O[C@H](c2ccccc2)Cc2c1ccc(O)c2O	C16H17NO3	unknown
+CCCc1cc2c(s1)CN[C@@H]1CCc3cc(OC(C)=O)c(OC(C)=O)cc3[C@@H]21	C22H25NO4S	unknown
+Cc1cccc(NC(=O)CN2CCC(c3ccccn3)CC2)c1	C19H23N3O	unknown
+Cc1cccc(C(=O)NCN2CCN(c3ccccc3C#N)CC2)c1	C20H22N4O	unknown
+Clc1cccc(Cl)c1NC1=NCCN1	C9H9Cl2N3	unknown
+N=C(N)NC(=O)Cc1c(Cl)cccc1Cl	C9H9Cl2N3O	unknown
+CO[C@]12C[C@@H](COC(=O)c3cncc(Br)c3)CN(C)[C@@H]1Cc1cn(C)c3cccc2c13	C24H26BrN3O3	unknown
+CSCCC(N)C(=O)N[C@@]1(C(=O)O)CS(=O)(=O)[C@H]2[C@H](C(=O)O)[C@H]21	C12H18N2O7S2	unknown
+N[C@@]1(C(=O)O)CS(=O)(=O)[C@H]2[C@H](C(=O)O)[C@H]21	C7H9NO6S	unknown
+N[C@](CC1c2ccccc2Oc2ccccc21)(C(=O)O)[C@H]1C[C@@H]1C(=O)O	C20H19NO5	unknown
+N#Cc1cccc(C(=O)Nc2cc(-c3ccccc3)nn2-c2ccccc2)c1	C23H16N4O	unknown
+O=C(c1ccc(F)cc1)N1CCC[C@H](c2nc(-c3ccc(F)cc3)no2)C1	C20H17F2N3O2	unknown
+NS(=O)(=O)c1cc2c(cc1Cl)NC(C1CC3C=CC1C3)NS2(=O)=O	C14H16ClN3O4S2	unknown
+O=C(c1ccc2nccnc2c1)N1CCCCC1	C14H15N3O	unknown
+O=C(c1ccc2nonc2c1)N1CCCCC1	C12H13N3O2	unknown
+CC(CNS(=O)(=O)C(C)C)c1ccc(-c2ccc(C#N)cc2)cc1	C19H22N2O2S	unknown
+CNC(=O)c1ccc(-c2ccc([C@](C)(F)CNS(=O)(=O)C(C)C)cc2)cc1	C20H25FN2O3S	unknown
+NCC(=O)O	C2H5NO2	unknown
+N[C@H](CO)C(=O)O	C3H7NO3	unknown
+N[C@@H]1CONC1=O	C3H6N2O2	unknown
+CNCC(=O)O	C3H7NO2	unknown
+CN(CC[C@@H](Oc1ccc(-c2ccccc2)cc1)c1ccc(F)cc1)CC(=O)O	C24H24FNO3	unknown
+CN(CCC(Oc1ccc(C(F)(F)F)cc1)c1ccccc1)CC(=O)O	C19H20F3NO3	unknown
+COc1cc2c(cc1OC)[C@@H](c1ccccc1)[C@@H](CN(C)CC(=O)O)CC2	C22H27NO4	unknown
+O=C(N[C@@H](c1ccccc1)[C@@H]1CCCCN1)c1cccc(C(F)(F)F)c1Cl	C20H20ClF3N2O	unknown
+O=C(NC[C@]1(CC2CC2)CC[C@H](S(=O)(=O)CC2CC2)CC1)c1ccc(Cl)cc1Cl	C22H29Cl2NO3S	unknown
+CCOC(=O)c1ncn2c1CN(C)C(=O)c1cc(F)ccc1-2	C15H14FN3O3	aryldiazepine
+CCc1c(C(=O)OC)ncc2[nH]c3cc(OC)c(OC)cc3c12	C17H18N2O4	unknown
+Cc1cc(-c2nnc3c4ccccc4c(OCc4cn(C)nn4)nn23)no1	C17H14N8O2	unknown
+Cc1cc(-c2nncc3c(C(C)(C)C)c(OCc4ncnn4C)nn23)no1	C17H20N8O2	unknown
+Cn1c(=O)c2c(ncn2C)n(C)c1=O	C8H10N4O2	unknown
+Cn1c(=O)c2[nH]cnc2n(C)c1=O	C7H8N4O2	unknown
+CCCn1c(=O)c2[nH]c(C3CCCC3)nc2n(CCC)c1=O	C16H24N4O2	unknown
+Nc1nc(NCCc2ccc(O)cc2)nc2nc(-c3ccco3)nn12	C16H15N7O2	unknown
+CCCn1c(=O)c2[nH]c([C@H]3CCC(=O)C3)nc2n(CCC)c1=O	C16H22N4O3	unknown
+CCn1c(=O)c2c(nc(/C=C/c3ccc(OC)c(OC)c3)n2C)n(CC)c1=O	C20H24N4O4	unknown
+COCCOc1ccc(N2CCN(CCn3ncc4c3nc(N)n3nc(-c5ccco5)nc43)CC2)cc1	C25H29N9O3	unknown
+Cc1cc(Cn2nnc3c(-c4ccco4)nc(N)nc32)ccc1N	C16H15N7O	unknown
+CC(C)n1cc(-c2ncc(N)nc2-c2ccc(F)cc2)ccc1=O	C18H17FN4O	unknown
+CC(=O)N(C)C1(c2ccccc2)CCN(CCC[C@]2(c3ccc(Cl)c(Cl)c3)CCCN(C(=O)c3ccccc3)C2)CC1	C35H41Cl2N3O2	unknown
+CC[C@H](NC(=O)c1c(O)c(-c2ccccc2)nc2ccccc12)c1ccccc1	C25H22N2O2	unknown
+Cc1ccc(C2=CS(=O)(=O)CCCS2(=O)=O)cc1	C12H14O4S2	unknown
+C[C@@H](O[C@H]1OCCN(Cc2n[nH]c(=O)[nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1	C23H21F7N4O3	unknown
+COc1ccc(OC(F)(F)F)cc1CN[C@H]1CCCN[C@H]1c1ccccc1	C20H23F3N2O2	unknown
+COc1ccc([C@H]2CNC(=O)[C@H](Cc3cccc(C)c3)C2)cc1OC1CCCC1	C25H31NO3	unknown
+O=C(NC1CC1)c1cn(-c2cccc(-c3ccc([C@@H]4C[C@H]4C(=O)O)c(F)c3)c2)c2ncccc2c1=O	C28H22FN3O4	unknown
+COc1ccc(Cc2nn3c([C@@H](CCc4ccccc4)[C@@H](C)O)nc(C)c3c(=O)[nH]2)cc1OC	C26H30N4O4	unknown
+C[C@H](Cc1nc2c(cnn2-c2ccccc2Cl)c(=O)[nH]1)C(F)(F)F	C15H12ClF3N4O	unknown
+Cn1cc(-c2ccncc2)c(-c2ccc(OCc3ccc4ccccc4n3)cc2)n1	C25H20N4O	unknown
+CCCCCN1N=C(C(=O)NC(C)(C)c2ccccc2)CC1c1ccccc1	C24H31N3O	cannabinoid
+CC1(C)C(C(=O)c2c[nH]c3ccccc23)C1(C)C	C16H19NO	cannabinoid
+COc1ccc(C(=O)c2cn(C)c3ccccc23)cc1	C17H15NO2	cannabinoid
+COC(=O)c1cn(CC2CCCCC2)c2ccccc12	C17H21NO2	cannabinoid
+CCCCCn1nc(C(=O)OCC(C)C)c2ccccc21	C17H24N2O2	cannabinoid
+CCCCCn1cc(C(=O)N(C(=O)c2cn(CCCCC)c3ccccc23)c2cccc3ccccc23)c2ccccc21	C38H39N3O2	cannabinoid
+CCCCCn1nc2ccccc2c1C(=O)Nc1cccc2ccccc12	C23H23N3O	cannabinoid
+C=C(C)C(C)(C)CC(=O)c1cn(CCCCCF)c2ccccc12	C21H28FNO	cannabinoid
+C=C(C)C(C)(C)CC(=O)c1cn(CC2CCOCC2)c2ccccc12	C22H29NO2	cannabinoid
+CCCCCn1ccc2ccccc21	C13H17N	unknown
+Oc1cccc2cccnc12	C9H7NO	unknown
+CC1C(c2ccc3c(c2)OCO3)OCCN1C	C13H17NO3	unknown
+CN(C)CCN(Cc1ccccc1)c1ccccn1	C16H21N3	unknown
+CCOc1ccc(Cl)cc1CNCCc1c2c(c(Br)c3c1OCC3)OCC2	C21H23BrClNO3	unknown
+COc1cc(CCN)ccc1OCc1ccccc1	C16H19NO2	unknown
+COc1ccc(OC)c(CCNCc2cc(OC)c(OC)c(OC)c2)c1	C20H27NO5	unknown
+COc1c(Cl)c(Cl)c(Cl)c(CCN)c1OC	C10H12Cl3NO2	unknown
+COc1c(Cl)c(Cl)c(CCN)c(Cl)c1OC	C10H12Cl3NO2	unknown
+COc1cc(N(F)F)c(OC)cc1CCN	C10H14F2N2O2	prophetic
+COc1cc(C(F)Cl)c(OC)cc1CCN	C11H15ClFNO2	prophetic
+COc1cc(C(Cl)(Cl)Cl)c(OC)cc1CCN	C11H14Cl3NO2	prophetic
+COc1cc(C(C#N)(C#N)C#N)c(OC)cc1CCN	C14H14N4O2	prophetic
+C=C(C)Cc1cc(OC)c(CCN)cc1OC	C14H21NO2	prophetic
+COc1cc(Cc2ccccc2)c(OC)cc1CCN	C17H21NO2	prophetic
+COc1cccc(Cc2cc(OC)c(CCN)cc2OC)c1	C18H23NO3	prophetic
+COc1cc(C(C)(F)F)c(OC)cc1CCN	C12H17F2NO2	prophetic
+COc1cc(C(F)CF)c(OC)cc1CCN	C12H17F2NO2	prophetic
+COc1cc(C(F)(F)C(F)(F)F)c(OC)cc1CCN	C12H14F5NO2	prophetic
+COc1cc(CCCF)c(OC)cc1CCN	C13H20FNO2	prophetic
+COc1cc(C(F)(F)C(F)(F)C(F)(F)F)c(OC)cc1CCN	C13H14F7NO2	prophetic
+COc1cc(C2CCC2)c(OC)cc1CCN	C14H21NO2	prophetic
+COc1cc(C2CCO2)c(OC)cc1CCN	C13H19NO3	prophetic
+COc1cc(C2CC(F)(F)C2)c(OC)cc1CCN	C14H19F2NO2	prophetic
+COc1cc(Cc2cccs2)c(OC)cc1CCN	C15H19NO2S	prophetic
+COc1cc(Cc2ccsc2)c(OC)cc1CCN	C15H19NO2S	prophetic
+COc1cc(Cc2ccco2)c(OC)cc1CCN	C15H19NO3	prophetic
+COc1cc(Cc2ccoc2)c(OC)cc1CCN	C15H19NO3	prophetic
+COc1cc(CC2CCCO2)c(OC)cc1CCN	C15H23NO3	prophetic
+COc1cc(CC2CCOC2)c(OC)cc1CCN	C15H23NO3	prophetic
+COc1cc(Cc2nc(C)no2)c(OC)cc1CCN	C14H19N3O3	prophetic
+COc1cc(OC(F)(F)F)c(OC)cc1CCN	C11H14F3NO3	prophetic
+COc1cccc(OCc2cc(OC)c(CCN)cc2OC)c1	C18H23NO4	prophetic
+COc1cc(N2CC3(COC3)C2)c(OC)cc1CCN	C15H22N2O3	prophetic
+COc1cc(N2CC(F)(F)C2)c(OC)cc1CCN	C13H18F2N2O2	prophetic
+COc1cc(N2CCCC2)c(OC)cc1CCN	C14H22N2O2	prophetic
+COc1cc(N2CCCO2)c(OC)cc1CCN	C13H20N2O3	prophetic
+COc1cc(N2CCCCC2)c(OC)cc1CCN	C15H24N2O2	prophetic
+COc1cc(N2CCOCC2)c(OC)cc1CCN	C14H22N2O3	prophetic
+COc1cc(N2CCSCC2)c(OC)cc1CCN	C14H22N2O2S	prophetic
+COc1cc(N2CCC(F)(F)CC2)c(OC)cc1CCN	C15H22F2N2O2	prophetic
+COc1cc(N2CCCCCC2)c(OC)cc1CCN	C16H26N2O2	prophetic
+COc1cc(N2CCCOCC2)c(OC)cc1CCN	C15H24N2O3	prophetic
+COc1c(CCN)cc(OC)c2occc12	C12H15NO3	prophetic
+COc1cc(CCN)c(OC)c2occc12	C12H15NO3	prophetic
+C=CC(C)c1cc(OC)c(CCN)cc1OC	C14H21NO2	prophetic
+COc1cc(Cc2nc(C)cs2)c(OC)cc1CCN	C15H20N2O2S	prophetic
+CN(C)CCc1c[nH]c2ccc(Cl)c(Cl)c12	C12H14Cl2N2	prophetic,tryptamine
+CN(C)CCc1c[nH]c2ccc(O)c(Cl)c12	C12H15ClN2O	prophetic,tryptamine
+Cc1c(O)ccc2[nH]cc(CCN(C)C)c12	C13H18N2O	prophetic,tryptamine
+CN(C)CCc1c[nH]c2c(F)cc(F)cc12	C12H14F2N2	prophetic,tryptamine
+CCOc1ccccc1-c1cc(Cl)cc2[nH]cc(CCN(C)C)c12	C20H23ClN2O	prophetic,tryptamine
+CN(C)CCc1c[nH]c2ccc3c(c12)CCO3	C14H18N2O	prophetic,tryptamine
+CN(C)CCc1c[nH]c2ccc3c(c12)OCC3	C14H18N2O	prophetic,tryptamine
+CN(C)CCc1c[nH]c2ccc3c(c12)COC3	C14H18N2O	prophetic,tryptamine
+CN(C)CCc1c[nH]c2ccc3occc3c12	C14H16N2O	prophetic,tryptamine
+CN(C)CCc1c[nH]c2ccc3ccoc3c12	C14H16N2O	prophetic,tryptamine
+CN(C)CCc1c[nH]c2ccc3sccc3c12	C14H16N2S	prophetic,tryptamine
+CN(C)CCc1c[nH]c2ccc3ocnc3c12	C13H15N3O	prophetic,tryptamine
+CN(C)CCc1c[nH]c2ccc3c(c12)OCCO3	C14H18N2O2	prophetic,tryptamine
+CN(C)CCc1c[nH]c2ccc3c(c12)N(C)CCO3	C15H21N3O	prophetic,tryptamine
+CN(C)CCc1c[nH]c2ccc3nccnc3c12	C14H16N4	prophetic,tryptamine
+CN(C)CCc1c[nH]c2cccc(CCO)c12	C14H20N2O	prophetic,tryptamine
+CC(C)c1ccc2[nH]cc(CCN(C)C)c2c1	C15H22N2	prophetic,tryptamine
+C#Cc1ccc2[nH]cc(CCN(C)C)c2c1	C14H16N2	prophetic,tryptamine
+CN(C)CCc1c[nH]c2ccc(C(F)(F)F)cc12	C13H15F3N2	prophetic,tryptamine
+CC(C)Oc1ccc2[nH]cc(CCN(C)C)c2c1	C15H22N2O	prophetic,tryptamine
+CN(C)CCc1c[nH]c2ccc(OC(F)F)cc12	C13H16F2N2O	prophetic,tryptamine
+C=C(C)COc1ccc2[nH]cc(CCN(C)C)c2c1	C16H22N2O	prophetic,tryptamine
+COc1cccc(COc2ccc3[nH]cc(CCN(C)C)c3c2)c1	C20H24N2O2	prophetic,tryptamine
+COc1cccc(OCc2ccc3[nH]cc(CCN(C)C)c3c2)c1	C20H24N2O2	prophetic,tryptamine
+CN(C)CCc1c[nH]c2ccc(N3CCCC3)cc12	C16H23N3	prophetic,tryptamine
+CN(C)CCc1c[nH]c2ccc(N3CCC(F)(F)CC3)cc12	C17H23F2N3	prophetic,tryptamine
+CN(C)CCc1c[nH]c2ccc3c(c12)C=CCO3	C15H18N2O	prophetic,tryptamine
+COc1cc(CCN)c(O)cc1I	C9H12INO2	unknown
+C/C(=C\c1ccc2cc[nH]c2c1)[N+](=O)[O-]	C11H10N2O2	unknown
+C/C(=C\c1cccc2cc[nH]c12)[N+](=O)[O-]	C11H10N2O2	unknown
+COc1cc(CCNCc2ccccc2F)c(O)cc1I	C16H17FINO2	unknown
+COc1cc(CCNCc2cccc3c2OCO3)c(O)cc1I	C17H18INO4	unknown
+Cn1cc(CC[N+](C)(C)C)c2ccccc21	C14H21N2	tryptamine
+Cn1cc(CCN)c2ccccc21	C11H14N2	tryptamine
+CC(N)Cc1cc2ccccc2[nH]1	C11H14N2	unknown
+C/C(=C\c1cc2ccccc2[nH]1)[N+](=O)[O-]	C11H10N2O2	unknown
+C/C(=C\c1c[nH]c2ccccc12)[N+](=O)[O-]	C11H10N2O2	unknown
+C/C(=C\c1cccc2[nH]ccc12)[N+](=O)[O-]	C11H10N2O2	unknown
+C/C(=C\c1ccc2[nH]ccc2c1)[N+](=O)[O-]	C11H10N2O2	unknown
+O=C1[C@@H]2[C@H]3CC[C@H](C3)[C@@H]2C(=O)N1CCCCN1CCN(c2ncccn2)CC1	C21H29N5O2	unknown
+O=C1CC2(CCCC2)CC(=O)N1CCCCN1CCN(c2ncc(O)cn2)CC1	C21H31N5O3	unknown
+O=C1CC2(CCCC2)C(O)C(=O)N1CCCCN1CCN(c2ncccn2)CC1	C21H31N5O3	unknown
+ClCC1=Nc2ccccc2C(c2ccccc2)=NO1	C15H11ClN2O	prophetic
+[O-][n+]1c(CCl)nc2ccccc2c1-c1ccccc1	C15H11ClN2O	unknown
+[O-][n+]1c(CCl)nc2ccc(Cl)cc2c1-c1ccccc1	C15H10Cl2N2O	prophetic
+CNCc1nc2ccc(Cl)cc2c(-c2ccccc2)[n+]1[O-]	C16H14ClN3O	prophetic
+O=C1C[N+]([O-])=C(c2ccccc2)c2cc(Cl)ccc2N1	C15H11ClN2O2	aryldiazepine
+CN1CN=C(c2ccccc2)c2cc(Cl)ccc2C1=O	C16H13ClN2O	aryldiazepine
+CN1CCN(CC(=O)OC2N=C(c3ccccc3Cl)c3cc(Cl)ccc3N(C)C2=O)CC1	C23H24Cl2N4O3	aryldiazepine
+Clc1ccc2c(c1)C(c1ccccc1Cl)=NCc1cncnc1-2	C18H11Cl2N3	aryldiazepine
+OC1N=C(c2ccccc2Cl)c2cc(Cl)ccc2-c2ncncc21	C18H11Cl2N3O	aryldiazepine
+Oc1ccc(C2=NCc3cncnc3-c3ccc(Cl)cc32)c(Cl)c1	C18H11Cl2N3O	unknown
+CCCOC(=O)c1cc2c(cn1)[nH]c1ccccc12	C15H14N2O2	unknown
+CCOC(=O)c1ncc2[nH]c3ccc(OC)cc3c2c1COC	C17H18N2O4	unknown
+CCCOc1ccc2[nH]c3cnc(C(=O)OCC)c(COC)c3c2c1	C19H22N2O4	unknown
+CCOC(=O)c1ncc2[nH]c3ccc(OCc4ccccc4)cc3c2c1COC	C23H22N2O4	unknown
+COCc1c(C(=O)OC(C)C)ncc2[nH]c3ccc(OCc4ccccc4)cc3c12	C24H24N2O4	unknown
+CN1CCN(C(=O)OC2C3=C(SCCS3)C(=O)N2c2ccc3ccc(Cl)nc3n2)CC1	C20H20ClN5O3S2	unknown
+O=C(CC1c2ccccc2C(=O)N1c1ccc2ccc(Cl)nc2n1)N1CCC2(CC1)OCCO2	C25H23ClN4O4	unknown
+O=c1c2cnc3ccccc3c2[nH]n1-c1ccccc1	C16H11N3O	unknown
+COc1ccc(-n2[nH]c3c(cnc4ccccc43)c2=O)cc1	C17H13N3O2	unknown
+O=c1c2cnc3ccccc3c2[nH]n1-c1ccc(Cl)cc1	C16H10ClN3O	unknown
+O=c1c2cnc3ccc(OCc4ccccc4)cc3c2[nH]n1-c1ccccc1	C23H17N3O2	unknown
+CCCN(CCC)C(=O)Cc1c(-c2ccc(Cl)cc2)nc2ccc(Cl)cn12	C21H23Cl2N3O	unknown
+CCCC(=O)N(C)Cc1c(-c2ccc(Cl)cc2)nc2ccccn12	C19H20ClN3O	unknown
+COc1ccccc1NC(=O)C1=C2Nc3ccccc3N2CCC1=O	C19H17N3O3	unknown
+O=C1CCN2C(=C1C(=O)Nc1ccccc1Cl)Nc1ccccc12	C18H14ClN3O2	unknown
+O=C1CCN2C(=C1C(=O)Nc1ccccc1)Nc1ccccc12	C18H15N3O2	unknown
+O=C1CCN2C(=C1C(=O)Nc1ccccc1F)Nc1ccccc12	C18H14FN3O2	unknown
+O=C1CCN2C(=C1C(=O)NCc1ccccc1)Nc1ccccc12	C19H17N3O2	unknown
+O=C1CCN2C(=C1C(=O)Nc1ccncc1)Nc1ccccc12	C17H14N4O2	unknown
+CN1C2=C(C(=O)Nc3ccccc3F)C(=O)CCN2c2ccccc21	C19H16FN3O2	unknown
+CCOCN1C2=C(C(=O)Nc3ccccc3F)C(=O)CCN2c2ccc(F)cc21	C21H19F2N3O3	unknown
+CC(C)n1c(=O)c2c(-c3noc(C4CC4)n3)ncn2c2ccccc21	C18H17N5O2	unknown
+C[C@@H]1CN(C(=O)N2Cc3c(C(=O)OC(C)(C)C)ncn3-c3ccc(Cl)cc32)C[C@H](C)N1	C22H28ClN5O3	unknown
+CC1=COc2c(cccc2N2CCNCC2)O1	C13H16N2O2	unknown
+O=C1C2CCCN2C(=O)N1CCCCN1CCN(c2cccc(C(F)(F)F)c2)CC1	C21H27F3N4O2	unknown
+COc1ccccc1N1CCN(CCNC(=O)c2ccc(F)cc2)CC1	C20H24FN3O2	unknown
+O=C(NCCN1CCN(c2cccc3c2OCC(CO)O3)CC1)c1ccc(F)cc1	C22H26FN3O4	unknown
+CC(C)Oc1ccccc1N1CCN(Cc2cccc(C(=O)N3CCCCC3)c2)CC1	C26H35N3O2	unknown
+O=C(c1cccc(CN2CCN3c4ccccc4OCC3C2)c1)N1CCCCC1	C24H29N3O2	unknown
+CCCN(CCCCN1C(=O)CC2(CCCC2)CC1=O)C1COc2cccc(OC)c2C1	C26H38N2O4	unknown
+O=C1c2ccccc2C(=O)N1CCN1CCN(c2ccccc2)CC1	C20H21N3O2	unknown
+O=C1c2ccccc2C(=O)N1CCCN1CCN(c2ccccc2)CC1	C21H23N3O2	unknown
+O=C1c2ccccc2C(=O)N1CCCCN1CCN(c2ccccc2)CC1	C22H25N3O2	unknown
+O=C1c2ccccc2C(=O)N1CCCCCN1CCN(c2ccccc2)CC1	C23H27N3O2	unknown
+COc1ccccc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	C21H25FN2O2	unknown
+COc1ccccc1N1CCN(CCCC(O)c2ccc(F)cc2)CC1	C21H27FN2O2	unknown
+COc1ccccc1N1CCN(CCCCc2ccc(F)cc2)CC1	C21H27FN2O	unknown
+O=C1CCC(=O)N1C[C@H]1CC[C@H]2CN(c3ncccn3)CCN2C1	C17H23N5O2	unknown
+CC1(C)CC(=O)N(CCCCN2CCN(c3ncccn3)CC2)C(=O)C1	C19H29N5O2	unknown
+O=C1c2ccccc2S(=O)(=O)N1CCCCN1CCN(c2ncccn2)CC1	C19H23N5O3S	unknown
+O=C1[C@@H]2[C@@H]3C=C[C@@H]([C@H]4C=C[C@H]43)[C@@H]2C(=O)N1CCCCN1CCN(c2ncccn2)CC1	C24H29N5O2	unknown
+COc1ccccc1N1CCN(CCCCNC(C)=O)CC1	C17H27N3O2	unknown
+COc1ccccc1N1CCN(CCCCNC(=O)c2ccccc2)CC1	C22H29N3O2	unknown
+Clc1cnn(CCCCN2CCN(c3ncccn3)CC2)c1	C15H21ClN6	unknown
+COc1ccccc1N1CCN(C[C@@H](C(=O)NC(C)(C)C)c2ccccc2)CC1	C24H33N3O2	unknown
+CN(C)CCO[C@]1(c2ccccc2)C[C@H]2CC[C@]1(C)C2(C)C	C20H31NO	unknown
+CN(C)CCO/N=C(/C=C/c1ccc(O)cc1)c1ccccc1F	C19H21FN2O2	unknown
+Cc1cc2c(cc1Cl)N(C(=O)Nc1ccc(Oc3cccnc3C)nc1)CC2	C21H19ClN4O2	unknown
+O=C(NCCN1CCN(c2ncccn2)CC1)C12CC3CC(CC(C3)C1)C2	C21H31N5O	unknown
+Cc1cccc2c1OC(CNCCNC(=O)C13CC4CC(CC(C4)C1)C3)CO2	C23H32N2O3	unknown
+Cc1nccn1CC1CCc2c(c3ccccc3n2C)C1=O	C18H19N3O	unknown
+CN1C2CCC1CC(OC(=O)c1ccccc1)C2	C15H19NO2	unknown
+CN1C2CCC1[C@@H](C(=O)O)[C@@H](O)C2	C9H15NO3	unknown
+COC(=O)C1C(=O)CC2CCC1N2C	C10H15NO3	unknown
+COC(=O)[C@@H]1C2CCC(C[C@@H]1O)N2C	C10H17NO3	unknown
+CN1C2CCC1CC(=O)C2	C8H13NO	unknown
+C=CCN1CC[C@]23c4c5ccc(O)c4O[C@H]2C(=O)CC[C@@]3(O)[C@H]1C5	C19H21NO4	unknown
+CC(C)(O)c1ccn2c(-c3ccc(F)c(-c4ccc(F)cc4C#N)c3)cnc2c1F	C23H16F3N3O	unknown
+C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@H](NC(=O)CCC(=O)O)c1ccccc1	C35H42N4O6	unknown
+CN1C2CCC1[C@@H](C(=O)O)[C@@H](OC(=O)/C=C/c1ccccc1)C2	C18H21NO4	unknown
+CN1C2CCC1[C@@H](C(=O)O)[C@@H](OC(=O)c1cccc(O)c1)C2	C16H19NO5	unknown
+CC[C@@H](C)Nc1nc(C)nc2c(-c3ccc(OC)nc3C)c(C)nn12	C18H24N6O	unknown
+CCO/N=C(\C)c1ccc2c(c1)ncn2-c1cccc(-c2cccnc2)c1	C22H20N4O	unknown
+Cn1c2ccc(F)cc2c2c(C(=O)N3CCCC3)cn(-c3ccccc3)c(=O)c21	C23H20FN3O2	unknown
+CCn1ncnc1COc1nn2c(-c3ccccc3F)nnc2cc1C(C)(C)C	C20H22FN7O	unknown
+N#[N+][O-]	N2O	unknown
+Cn1ncnc1COc1nn2c(-c3cc(F)ccc3F)nnc2cc1C(C)(C)C	C19H19F2N7O	unknown
+Cn1ncnc1COc1nn2c(-c3ccccc3)nnc2cc1C1CCC1	C19H19N7O	unknown
+Cn1ncnc1COc1nn2c(-c3c(F)cccc3F)nnc2cc1C1CCC1	C19H17F2N7O	unknown
+CC(C)(O)c1ccc2c(c1)ncn2-c1cccc(-c2ccccc2C#N)c1	C23H19N3O	unknown
+C=C1CC[C@@]2(O)[C@H]3Cc4ccc(O)c5c4[C@@]2(CCN3CC2CC2)[C@H]1O5	C21H25NO3	unknown
+CCCCN(CC)c1nc(C)nc2c1c(C)cn2-c1c(C)cc(C)cc1C	C23H32N4	unknown
+O=C(c1ccccn1)c1cnn2c(-c3ccncc3)ccnc12	C17H11N5O	unknown
+Cc1cccc(NC(=O)N[C@@H]2N=C(N3CC4CCC(CC4)C3)c3ccccc3N(C)C2=O)c1	C26H31N5O2	unknown
+CN1C2CCC1CC(O)C2	C8H15NO	unknown
+CCCCN(CC)c1nc(C)nc2c1c(C)c(C)n2-c1c(C)cc(C)cc1C	C24H34N4	unknown
+CC(C)(O)c1cnn2c(-c3ccc(F)c(-c4c(F)cccc4C#N)c3)cnc2n1	C21H15F2N5O	unknown
+COC(=O)[C@H]1C2CCC(C[C@H]1OC(=O)c1ccccc1)N2C	C17H21NO4	unknown
+CN1C2CCC1[C@@H](C(=O)O)[C@@H](OC(=O)c1ccccc1)C2	C16H19NO4	unknown
+O=C(O[C@H]1CC2CCC(N2)[C@H]1C(=O)O)c1ccccc1	C15H17NO4	unknown
+CN1C2CC=C(C(=O)O)C1CC2	C9H13NO2	unknown
+COC(=O)C1=CCC2CCC1N2C	C10H15NO2	unknown
+COC(=O)C1=CCC2CCC1N2	C9H13NO2	unknown
+COC(=O)[C@@H]1C2CCC(C[C@@H]1O)N2	C9H15NO3	unknown
+COC(=O)[C@@H]1C2CCC(C[C@@H]1OC(=O)c1cccc(O)c1)N2C	C17H21NO5	unknown
+COC(=O)[C@@H]1C2CCC(C[C@@H]1OC(=O)c1ccc(O)cc1)N2C	C17H21NO5	unknown
+CCOC(=O)[C@@H]1C2CCC(C[C@@H]1OC(=O)c1ccccc1)N2	C17H21NO4	unknown
+CCC(C)(CN(C)C)OC(=O)c1ccccc1	C14H21NO2	unknown
+CCN(CC)CCOC(=O)c1ccc(N)cc1	C13H20N2O2	unknown
+CN(C)CCc1c[nH]c2ccc(Cn3cncn3)cc12	C15H19N5	tryptamine
+CN(C)CCc1c[nH]c2ccc(C[C@H]3COC(=O)N3)cc12	C16H21N3O2	tryptamine
+O=C(Cl)C(=O)c1c[nH]c2ccccc12	C10H6ClNO2	unknown
+CN(C)C(=O)C(=O)c1c[nH]c2ccccc12	C12H12N2O2	tryptamine
+CN(C)C(=O)C(=O)c1c[nH]c2cccc(OCc3ccccc3)c12	C19H18N2O3	tryptamine
+O[C@](CCN1CCCCC1)(c1ccccc1)[C@H]1CC2C=CC1C2	C21H29NO	unknown
+CN(C)CCc1c[nH]c2cccc(OP(=O)(OCc3ccccc3)OCc3ccccc3)c12	C26H29N2O4P	tryptamine
+O=CCc1c[nH]c2cccc(O)c12	C10H9NO2	unknown
+O=C(O)Cc1c[nH]c2cccc(O)c12	C10H9NO3	unknown
+OCCc1c[nH]c2cccc(O)c12	C10H11NO2	unknown
+CN(C)CCc1c[nH]c2cccc(O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O)c12	C18H24N2O7	tryptamine
+COC1=CC=C2[C@H]3Cc4ccc(O)c5c4[C@@]2(CCN3C)[C@H]1O5	C18H19NO3	unknown
+COC1=CC=C2[C@H]3Cc4ccc(OC)c5c4[C@@]2(CCN3C)[C@H]1O5	C19H21NO3	unknown
+CN1CC[C@]23c4c5ccc(O)c4O[C@H]2C(=O)CC[C@@]3(O)[C@H]1C5	C17H19NO4	unknown
+COc1ccc2c3c1O[C@H]1C(=O)CC[C@H]4[C@@H](C2)N(C)CC[C@]314	C18H21NO3	unknown
+COc1ccc2c3c1O[C@H]1C(=O)CC[C@@]4(O)[C@@H](C2)N(C)CC[C@]314	C18H21NO4	unknown
+CN1CC[C@]23c4c5ccc(O)c4O[C@H]2CCC[C@H]3[C@H]1C5	C17H21NO2	unknown
+COc1ccc(C=O)cc1O	C8H8O3	unknown
+COc1ccc(C=O)c(I)c1O	C8H7IO3	unknown
+COc1ccc2c3c1O[C@H]1C(=O)C=C[C@@]4(O)[C@@H](C2)N(C)CC[C@]314	C18H19NO4	unknown
+COc1ccc(CC/N=C/c2cccc3c2OCO3)cc1OC	C18H19NO4	unknown
+COc1ccc2c(CCN)c[nH]c2c1	C11H14N2O	tryptamine
+CCC(Cc1c2c(c(Br)c3c1OCC3)OCC2)NCc1ccccc1O	C21H24BrNO3	unknown
+CC(Cc1c2ccoc2c(Br)c2ccoc12)NCc1ccccc1O	C20H18BrNO3	unknown
+NCC(CN)c1ccccc1	C9H14N2	unknown
+NCC(CN)c1ccc2c(c1)OCO2	C10H14N2O2	unknown
+COc1cc(C(CN)CN)cc(OC)c1OC	C12H20N2O3	unknown
+COc1cc(C(CN)CN)ccc1O	C10H16N2O2	unknown
+CN(C)c1ccc(C(CN)CN)cc1	C11H19N3	unknown
+COc1ccc(OC)c(C(CN)CN)c1	C11H18N2O2	unknown
+CSc1ccc(C(CN)CN)cc1	C10H16N2S	unknown
+C[N+](C)([O-])CCc1c[nH]c2ccc(Br)cc12	C12H15BrN2O	tryptamine
+CC[N+]([O-])(CC)CCc1c[nH]c2ccccc12	C14H20N2O	tryptamine
+CCC[N+]([O-])(CCC)CCc1c[nH]c2ccccc12	C16H24N2O	tryptamine
+C[N+](C)([O-])CCc1c[nH]c2ccc(Cl)cc12	C12H15ClN2O	tryptamine
+CC(C)C[N+]([O-])(CCc1c[nH]c2ccccc12)CC(C)C	C18H28N2O	tryptamine
+COc1ccccc1CNCCc1c2ccoc2c(Br)c2ccoc12	C20H18BrNO3	unknown
+CSc1ccc2c(CCN)c[nH]c2c1	C11H14N2S	tryptamine
+CCc1ccc2c(CCN)c[nH]c2c1	C12H16N2	tryptamine
+C=CCNCCc1c[nH]c2ccccc12	C13H16N2	tryptamine
+CSc1ccc2c(CCN)c(C(=O)O)[nH]c2c1	C12H14N2O2S	tryptamine
+CSc1ccc2c(CC[N+](C)(C)C)c[nH]c2c1	C14H21N2S	tryptamine
+O=C1CC(=O)N(c2ccccc2)c2cc(Cl)ccc2N1	C15H11ClN2O2	aryldiazepine
+COc1cccc(CNc2ccc3nc(-c4ccc(N)cc4)c(OC)n3n2)c1	C21H21N5O2	aryldiazepine
+CC[C@@H](C)N(C[C@@H](O)c1cccn1Cc1ccccc1F)[C@@H](C)CC	C21H31FN2O	unknown
+CC(C)N(C(=O)c1ccc(Cl)c(Cl)c1)[C@@H]1CCCC[C@H]1N(C)C	C18H26Cl2N2O	unknown
+CCCCC(NCC(C)C)C(=O)c1ccccc1	C16H25NO	beta-ketone
+COCN1C(=O)CN=C(c2ccccc2)c2cc([N+](=O)[O-])ccc21	C17H15N3O4	aryldiazepine
+Cc1nnc2n1-c1sc([N+](=O)[O-])cc1C(c1ccccc1Cl)=NC2	C15H10ClN5O2S	aryldiazepine
+O=C(O)C1N=C(c2ccccc2)c2cc([N+](=O)[O-])ccc2NC1=O	C16H11N3O5	aryldiazepine
+O=C1CN=C(C2=CCCCC2)c2cc(Cl)ccc2N1	C15H15ClN2O	aryldiazepine
+O=C1CN=C(c2ccccc2F)c2cc(Cl)ccc2N1CC(O)CO	C18H16ClFN2O3	aryldiazepine
+OCc1ncc2n1-c1ccc(Cl)cc1C(c1ccccc1F)=NC2	C18H13ClFN3O	aryldiazepine
+OCc1nnc2n1-c1ccc(Cl)cc1C(c1ccccc1Cl)=NC2	C17H12Cl2N4O	aryldiazepine
+c1cc2c(c(N3CCNCC3)c1)OCCO2	C12H16N2O2	unknown
+c1ccc2c(c1)CC(N1CCN(c3cccc4c3OCCO4)CC1)C2	C21H24N2O2	unknown
+COc1ccc(CCNCc2cccc3c2OCO3)cc1OC	C18H21NO4	unknown
+COc1ccccc1CNC(C)Cc1c2ccoc2c(Br)c2ccoc12	C21H20BrNO3	unknown
+Cc1ccccc1CNCCc1c[nH]c2ccccc12	C18H20N2	tryptamine
+Clc1ccccc1CNCCc1c[nH]c2ccccc12	C17H17ClN2	tryptamine
+Brc1ccccc1CNCCc1c[nH]c2ccccc12	C17H17BrN2	tryptamine
+Oc1cccc(CNCCc2c[nH]c3ccccc23)c1	C17H18N2O	tryptamine
+Cc1cccc(CNCCc2c[nH]c3ccccc23)c1	C18H20N2	tryptamine
+Fc1cccc(CNCCc2c[nH]c3ccccc23)c1	C17H17FN2	tryptamine
+Clc1cccc(CNCCc2c[nH]c3ccccc23)c1	C17H17ClN2	tryptamine
+Brc1cccc(CNCCc2c[nH]c3ccccc23)c1	C17H17BrN2	tryptamine
+COc1ccc(CNCCc2c[nH]c3ccccc23)cc1	C18H20N2O	tryptamine
+Cc1ccc(CNCCc2c[nH]c3ccccc23)cc1	C18H20N2	tryptamine
+Clc1ccc(CNCCc2c[nH]c3ccccc23)cc1	C17H17ClN2	tryptamine
+Brc1ccc(CNCCc2c[nH]c3ccccc23)cc1	C17H17BrN2	tryptamine
+O=[N+]([O-])c1ccc(CNCCc2c[nH]c3ccccc23)cc1	C17H17N3O2	tryptamine
+COc1cccc(CNCCc2c[nH]c3ccccc23)c1O	C18H20N2O2	tryptamine
+COc1cccc(CNCCc2c[nH]c3ccccc23)c1OC	C19H22N2O2	tryptamine
+Oc1c(Br)cccc1CNCCc1c[nH]c2ccccc12	C17H17BrN2O	tryptamine
+Oc1c(F)cccc1CNCCc1c[nH]c2ccccc12	C17H17FN2O	tryptamine
+Cc1ccc(O)c(CNCCc2c[nH]c3ccccc23)c1	C18H20N2O	tryptamine
+Oc1ccc(F)cc1CNCCc1c[nH]c2ccccc12	C17H17FN2O	tryptamine
+COc1ccc(F)cc1CNCCc1c[nH]c2ccccc12	C18H19FN2O	tryptamine
+COc1ccc(Br)cc1CNCCc1c[nH]c2ccccc12	C18H19BrN2O	tryptamine
+COc1ccc(Cl)cc1CNCCc1c[nH]c2ccccc12	C18H19ClN2O	tryptamine
+COc1ccc(OC)c(CNCCc2c[nH]c3ccccc23)c1	C19H22N2O2	tryptamine
+O=[N+]([O-])c1ccc(O)c(CNCCc2c[nH]c3ccccc23)c1	C17H17N3O3	tryptamine
+Oc1cc(Br)ccc1CNCCc1c[nH]c2ccccc12	C17H17BrN2O	tryptamine
+COc1ccc(CNCCc2c[nH]c3ccccc23)c(OC)c1	C19H22N2O2	tryptamine
+Oc1cccc(Br)c1CNCCc1c[nH]c2ccccc12	C17H17BrN2O	tryptamine
+Oc1cccc(F)c1CNCCc1c[nH]c2ccccc12	C17H17FN2O	tryptamine
+COc1ccc(CNCCc2c[nH]c3ccccc23)cc1OC	C19H22N2O2	tryptamine
+COc1ccc2[nH]cc(CCNCc3ccccc3Cl)c2c1	C18H19ClN2O	tryptamine
+COc1ccc(O)c(CNCCc2c[nH]c3ccc(OC)cc23)c1	C19H22N2O3	tryptamine
+COc1ccc2[nH]cc(CCNCc3cc(F)ccc3O)c2c1	C18H19FN2O2	tryptamine
+O=C(O)/C=C/c1ccccc1	C9H8O2	unknown
+COc1cc(/C=C/C(=O)O)cc(OC)c1OC	C12H14O5	unknown
+COc1ccc2[nH]cc(CC/N=C/c3ccccc3)c2c1	C18H18N2O	tryptamine
+COc1cc(O)ccc1C=O	C8H8O3	unknown
+COc1cc(OS(=O)(=O)C(F)(F)F)ccc1C=O	C9H7F3O5S	unknown
+COc1cc(-c2ccccc2OC)ccc1C=O	C15H14O3	unknown
+COc1cc(-c2ccccc2OC)ccc1/C=C/[N+](=O)[O-]	C16H15NO4	unknown
+CN(C)CCc1c[nH]c2cccc(OP(=O)(O)OCc3ccccc3)c12	C19H23N2O4P	tryptamine
+CN(C)CCc1c[nH]c2ccc(OCc3ccccc3)cc12	C19H22N2O	tryptamine
+COC(=O)C(CN)c1c[nH]c2ccc(OC)cc12	C13H16N2O3	tryptamine
+Cn1ncc(Br)c1-c1cccc(Nc2ccc(C(F)(F)F)cc2)c1	C17H13BrF3N3	unknown
+COc1ccc(Nc2ccc(Cl)cc2)cc1-c1c(Br)cnn1C	C17H15BrClN3O	unknown
+Cn1ncc(Br)c1-c1cccc(Nc2ccc(Cl)cc2)c1	C16H13BrClN3	unknown
+CSc1ccc(C(C[N+](=O)[O-])C[N+](=O)[O-])cc1	C10H12N2O4S	unknown
+COc1cccc(/C=C/N2CCCC2)c1[N+](=O)[O-]	C13H16N2O3	unknown
+COc1cccc2cc[nH]c12	C9H9NO	unknown
+COc1cccc2c(CC[N+](=O)[O-])c[nH]c12	C11H12N2O3	unknown
+COc1cccc2c(CCNC(=O)OCc3ccccc3)c[nH]c12	C19H20N2O3	tryptamine
+CC(C)CCN(CCc1c[nH]c2ccccc12)CCC(C)C	C20H32N2	tryptamine
+c1ccc2c(CCN(CC3CC3)CC3CC3)c[nH]c2c1	C18H24N2	tryptamine
+c1ccc2c(CCN(CC3CCCCC3)CC3CCCCC3)c[nH]c2c1	C24H36N2	tryptamine
+c1ccc(CN(CCc2c[nH]c3ccccc23)Cc2ccccc2)cc1	C24H24N2	tryptamine
+c1ccc(CN(CCc2c[nH]c3ccccc23)Cc2ccccn2)nc1	C22H22N4	tryptamine
+c1coc(CN(CCc2c[nH]c3ccccc23)Cc2ccco2)c1	C20H20N2O2	tryptamine
+c1csc(CN(CCc2c[nH]c3ccccc23)Cc2cccs2)c1	C20H20N2S2	tryptamine
+COc1cc(OC)c(OC)cc1CN(CCc1c[nH]c2ccccc12)Cc1cc(OC)c(OC)cc1OC	C30H36N2O6	tryptamine
+O=[N+]([O-])c1cccc(CN(CCc2c[nH]c3ccccc23)Cc2cccc([N+](=O)[O-])c2)c1	C24H22N4O4	tryptamine
+CC(C)CCNCCc1c[nH]c2ccccc12	C15H22N2	tryptamine
+CC(C)CCN(C)CCc1c[nH]c2ccccc12	C16H24N2	tryptamine
+CCN(CCc1c[nH]c2ccccc12)CCC(C)C	C17H26N2	tryptamine
+CCCN(CCc1c[nH]c2ccccc12)CCC(C)C	C18H28N2	tryptamine
+CC(C)CCN(CCc1c[nH]c2ccccc12)CC(C)C	C19H30N2	tryptamine
+CC(C)CCN(CCc1c[nH]c2ccccc12)Cc1ccco1	C20H26N2O	tryptamine
+CC(C)CCN(CCc1c[nH]c2ccccc12)Cc1cccs1	C20H26N2S	tryptamine
+CC(C)CCN(CCc1cn(S(=O)(=O)c2ccccc2)c2ccccc12)CCC(C)C	C26H36N2O2S	tryptamine
+CN(C)CCc1ccccc1I	C10H14IN	unknown
+COc1cc(I)c(CCN(C)C)cc1OC	C12H18INO2	unknown
+CCC(C)N(CC(O)c1cccn1Cc1ccccc1Cl)C(C)CC	C21H31ClN2O	unknown
+CCCCn1nc(C(=O)N[C@@H](Cc2ccccc2)C(N)=O)c2ccccc21	C21H24N4O2	cannabinoid
+CCC(=O)N(c1ccccc1)C1CCN(CCc2c[nH]c3ccccc23)CC1	C24H29N3O	fentanyl
+CC(C)=CC(=O)N(c1ccccc1)C1CCN(CCc2ccccc2)CC1	C24H30N2O	fentanyl
+O=C(c1ccco1)N(c1cccc(F)c1)C1CCN(CCc2ccccc2)CC1	C24H25FN2O2	fentanyl
+C/N=C(\c1ccccc1Cl)C1(O)CCCC1	C13H16ClNO	unknown
+Nc1ccc2c(c1)C(c1ccccc1Cl)=NCC(=O)N2	C15H12ClN3O	aryldiazepine
+O=C1Nc2ccc(Br)cc2C(c2ccccc2F)=NC1O	C15H10BrFN2O2	aryldiazepine
+COC(=O)[C@@H](NC(=O)c1cn(CCCCCF)c2ncccc12)C(C)(C)C	C20H28FN3O3	cannabinoid
+CCCCn1c(C)c(C(=O)c2cccc3ccccc23)c2ccccc21	C24H23NO	cannabinoid
+COC(=O)c1nn(Cc2ccc(F)cc2)c2ccccc12	C16H13FN2O2	cannabinoid
+CCCCCn1cc(C(=O)c2c(C)ccc3ccccc23)c2ccccc21	C25H25NO	cannabinoid
+CCC(NC(=O)c1cn(CCCCCF)c2ccccc12)c1ccccc1	C23H27FN2O	cannabinoid
+CCC[C@H](NC(=O)c1nn(Cc2ccc(F)cc2)c2ccccc12)C(=O)OC	C21H22FN3O3	cannabinoid
+CCC(F)CCn1nc(C(=O)N[C@H](C(=O)OC)C(C)(C)C)c2ccccc21	C20H28FN3O3	cannabinoid
+CCCC(F)Cn1nc(C(=O)N[C@H](C(=O)OC)C(C)(C)C)c2ccccc21	C20H28FN3O3	cannabinoid
+CCCC(F)Cn1nc(C(=O)N[C@H](C(=O)OC)C(C)C)c2ccccc21	C19H26FN3O3	cannabinoid
+CC(C)(C)C(NC(=O)c1nn(CCCCCF)c2ccccc12)c1ccccc1	C24H30FN3O	cannabinoid
+CC(C)C(NC(=O)c1cn(CCCCCF)c2ncccc12)C(N)=O	C18H25FN4O2	cannabinoid
+CC(C)(c1ccccc1)n1ccc2c(c1=O)c1ccccc1n2CC1CCCCC1	C27H30N2O	cannabinoid
+CC(C(=O)c1ccccc1Cl)N(C)C	C11H14ClNO	beta-ketone
+CC(C(=O)c1cccc(Cl)c1)N(C)C	C11H14ClNO	beta-ketone
+CNC(C)C(=O)c1cccc2ccccc12	C14H15NO	beta-ketone
+CNC(C)C(=O)c1ccc(Cl)s1	C8H10ClNOS	unknown
+CCCN(CCC)C(=O)Cc1c[nH]c2ccccc12	C16H22N2O	tryptamine
+c1ccc2c(c1)ccn2CC1CCCCC1	C15H19N	unknown
+COc1ccc(C(=O)c2c[nH]c3ccccc23)cc1	C16H13NO2	cannabinoid
+Fc1ccc(NC2CCN(Cc3ccccc3)CC2)cc1	C18H21FN2	fentanyl
+Fc1cccc(C(Cc2ccccc2)N2CCN(C3CCCCC3)CC2)c1	C24H31FN2	unknown
+Fc1ccccc1C(Cc1ccccc1)N1CCN(C2CCCCC2)CC1	C24H31FN2	unknown
+CN(C(=O)c1ccc(Cl)c(Cl)c1)[C@@H]1CCCC[C@H]1N	C14H18Cl2N2O	unknown
+Fc1ccccc1NC1CCN(Cc2ccccc2)CC1	C18H21FN2	fentanyl
+CCCN(C(=O)c1ccc(Cl)c(Cl)c1)[C@@H]1CCCC[C@H]1N(C)C	C18H26Cl2N2O	unknown
+Cc1cccc(NC2CCN(CCc3ccccc3)CC2)c1	C20H26N2	fentanyl
+CN(C)[C@@H]1CCCC[C@H]1N(C)C(=O)c1ccc2c(c1)OCO2	C17H24N2O3	unknown
+Fc1ccccc1CCN1CCC(Nc2ccccc2F)CC1	C19H22F2N2	fentanyl
+CCC(=O)N(c1ccc(F)cc1)C1CCN(Cc2ccccc2)CC1	C21H25FN2O	fentanyl
+CCC(=O)N(c1cccc(F)c1)C1CCN(Cc2ccccc2)CC1	C21H25FN2O	fentanyl
+O=C(C1CC1)N(c1ccccc1)C1CCNCC1	C15H20N2O	fentanyl
+CN[C@@H]1CCCC[C@H]1N(C)C(=O)c1ccc(Cl)c(Cl)c1	C15H20Cl2N2O	unknown
+CN(C)[C@@H]1CCCC[C@H]1N(C)C(=O)Cc1ccc(-c2ccccc2)cc1	C23H30N2O	unknown
+CN(C)[C@@H]1CCCC[C@H]1N(C)C(=O)c1ccc(Br)cc1	C16H23BrN2O	unknown
+CN(C)[C@@H]1CCCC[C@H]1N(C)C(=O)c1ccc2c(c1)OCCO2	C18H26N2O3	unknown
+CN(C)[C@@H]1CCCC[C@H]1N(C)C(=O)Cc1ccc2c(c1)OCCO2	C19H28N2O3	unknown
+C=CC(=O)N(c1ccc(Cl)cc1)C1CCN(CCc2ccccc2)CC1	C22H25ClN2O	fentanyl
+Fc1ccc(C(Cc2ccccc2)N2CCN(C3CCCCC3)CC2)cc1	C24H31FN2	unknown
+CC1Nc2ccc(Cl)cc2S(=O)(=O)N1	C8H9ClN2O2S	unknown
+Cc1ccc(NC(=O)C2(c3ccc4c(c3)OC(F)(F)O4)CC2)nc1-c1cccc(C(=O)O)c1	C24H18F2N2O5	unknown
+O=C1CC(=O)c2ccccc21	C9H6O2	unknown
+c1ccc2c(c1)CCC2	C9H10	unknown
+CC(C)CC(=O)C1C(=O)c2ccccc2C1=O	C14H14O3	unknown
+COc1ccc(OC)c(CCNCc2cccc3c2OCO3)c1	C18H21NO4	unknown
+CN1CCNC(Cc2ccccc2)C1	C12H18N2	unknown
+c1ccc(CC2CNCCN2)cc1	C11H16N2	unknown
+Fc1ccc(C2CNCCN2)cc1	C10H13FN2	unknown
+CC1CNCCN1Cc1ccccc1	C12H18N2	unknown
+COc1cc(CCN(Cc2ccccc2OC)C(C)=O)c(OC)cc1I	C20H24INO4	unknown
+COCC(=O)N(c1ccccc1C)C1CCN(CCc2ccccc2)CC1	C23H30N2O2	fentanyl
+Cc1ccccc1NC1CCN(CCc2ccccc2)CC1	C20H26N2	fentanyl
+O=C(NC12CC3CC(CC(C3)C1)C2)c1nn(CCCCCBr)c2ccccc12	C23H30BrN3O	cannabinoid
+CCCCC(NCC)C(=O)c1ccc2c(c1)OCO2	C15H21NO3	beta-ketone
+C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@@H]43)[C@@H]1CCC2=O	C18H24O2	unknown
+CCC(C)(NC(=O)c1nn(Cc2ccc(F)cc2)c2ccccc12)C(N)=O	C20H21FN4O2	cannabinoid
+CC(F)CCCn1cc(C(=O)C2C(C)(C)C2(C)C)c2ccccc21	C21H28FNO	cannabinoid
+CCC(F)CCn1cc(C(=O)C2C(C)(C)C2(C)C)c2ccccc21	C21H28FNO	cannabinoid
+C[C@]12C=CC(=O)C[C@@H]1CC[C@@H]1[C@@H]2CC[C@@]2(C)[C@H]1CC[C@]2(C)O	C20H30O2	unknown
+CCCC(NC)C(=O)c1cccc2c1OCO2	C13H17NO3	beta-ketone
+CC(=O)C(N)c1ccccc1F	C9H10FNO	unknown
+O=C(c1cccc2ccccc12)c1c[nH]c2ccccc12	C19H13NO	cannabinoid
+CNC(C)Cc1ccc(OC(=O)C(F)(F)F)c(O)c1	C12H14F3NO3	unknown
+CCC[C@H](NC(=O)c1cn(CC2CCCCC2)c2ccccc12)C(=O)OC	C22H30N2O3	cannabinoid
+C[C@]12CC[C@H](O)CC1=CC[C@@H]1[C@@H]2CC[C@@]2(C)[C@H]1CC[C@]2(C)O	C20H32O2	unknown
+C[C@]12C[C@H]3S[C@H]3C[C@@H]1CC[C@@H]1[C@@H]2CC[C@@]2(C)[C@H]1CC[C@]2(C)O	C20H32OS	unknown
+C[C@]12CCC(=O)C=C1CC[C@@H]1[C@@H]2CC[C@@]2(C)[C@H]1CC[C@]2(C)O	C20H30O2	unknown
+CCN(C)C(Cc1ccccc1)c1ccccc1	C17H21N	unknown
+CC(=O)N(c1ccccc1)C1CCNCC1	C13H18N2O	fentanyl
+CCC1(CCC(C)C)C(=O)NC(=O)NC1=O	C11H18N2O3	unknown
+C[C@]12CC[C@@H](O)C[C@@H]1CC[C@@H]1[C@@H]2CC[C@]2(C)C(=O)CC[C@@H]12	C19H30O2	unknown
+CCC1(CC)C(=O)NC(=O)NC1=O	C8H12N2O3	unknown
+CC(=O)O[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@H]3CC[C@]12C	C21H28O3	unknown
+C=CCCCCCCCCC(=O)O[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@H]3CC[C@]12C	C30H44O3	unknown
+C=CCC1(CC(C)C)C(=O)NC(=O)NC1=O	C11H16N2O3	unknown
+CCCC(C)(COC(N)=O)COC(=O)NC(C)C	C12H24N2O4	unknown
+CC1CN(CCc2ccccc2)CCC1Nc1ccccc1	C20H26N2	fentanyl
+Fc1ccc(NC2CCN(CCc3ccccc3)CC2)cc1	C19H23FN2	fentanyl
+CCc1cccc(-n2c(C)nc3ccccc3c2=O)c1	C17H16N2O	unknown
+CCc1ccc(-n2c(C)nc3ccccc3c2=O)cc1	C17H16N2O	unknown
+C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@@]3(F)[C@@H](O)C[C@@]21C	C20H29FO3	unknown
+CCCCCC(=O)N(c1ccccc1)C1CCN(CCc2ccccc2)CC1	C25H34N2O	fentanyl
+CNC(C)Cc1cccc(C)n1	C10H16N2	unknown
+CCCCCCCCCCC(=O)O[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@]12C	C29H46O3	unknown
+C[C@]12COC(=O)C[C@@H]1CC[C@@H]1[C@@H]2CC[C@@]2(C)[C@H]1CC[C@]2(C)O	C19H30O3	unknown
+CCC1(c2ccccc2)C(=O)NC(=O)NC1=O	C12H12N2O3	unknown
+C=CCC1(C(C)CCC)C(=O)NC(=O)NC1=O	C12H18N2O3	unknown
+CCCCCC(=O)O[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C	C25H38O3	unknown
+C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@@]43C)[C@@H]1CC[C@@H]2O	C19H28O2	unknown
+C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@@]43C)[C@@H]1CC[C@@H]2OC(=O)CCC1CCCC1	C27H40O3	unknown
+CCCCCCCCCC(=O)O[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C	C29H46O3	unknown
+CC(C)CCC(=O)O[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C	C25H38O3	unknown
+C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@@]43C)[C@@H]1CC[C@@H]2OC(=O)CCc1ccccc1	C28H36O3	unknown
+CCCCCCC(=O)O[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C	C26H40O3	unknown
+CCCCCn1nc(C(=O)NC(CC(C)C)C(N)=O)c2ccccc21	C19H28N4O2	cannabinoid
+CN(C(=O)c1nn(Cc2ccc(F)cc2)c2ccccc12)C(C)(C)C(N)=O	C20H21FN4O2	cannabinoid
+CCCC(NC(=O)c1nn(Cc2ccc(F)cc2)c2ccccc12)C(N)=O	C20H21FN4O2	cannabinoid
+CCC(=O)O[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C	C22H32O3	unknown
+CCCCCCCCCCC(=O)O[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C	C30H48O3	unknown
+C[C@]12C=CC3=C4CCC(=O)C=C4CC[C@H]3[C@@H]1CC[C@@H]2OC(=O)OCC1CCCCC1	C26H34O4	unknown
+CCCCNC(CCCC)C(=O)c1ccccc1	C16H25NO	beta-ketone
+CCCCCC(NCC)C(=O)c1ccccc1	C15H23NO	beta-ketone
+C=C(Br)COc1c(OC)cc(CCN)cc1OC	C13H18BrNO3	unknown
+O=C1CN=C(c2ccccc2Br)c2cc(F)ccc2N1	C15H10BrFN2O	aryldiazepine
+C[C@@H]1N=C(c2ccccc2F)c2cc(Br)ccc2NC1=O	C16H12BrFN2O	aryldiazepine
+C#Cc1ccc2c(c1)C(c1ccccc1F)=N[C@H](C)c1c(C(=O)N(C)C)ncn1-2	C23H19FN4O	aryldiazepine
+C#Cc1ccc2c(c1)C(c1ccccc1F)=N[C@H](C)c1c(C(=O)NCC)ncn1-2	C23H19FN4O	aryldiazepine
+C#Cc1ccc2c(c1)C(c1ccccc1F)=N[C@H](C)c1c(C(=O)NC3CC3)ncn1-2	C24H19FN4O	aryldiazepine
+C#Cc1ccc2c(c1)C(c1ccccc1F)=N[C@H](C)c1c(C(=O)N3CCCC3)ncn1-2	C25H21FN4O	aryldiazepine
+C#Cc1ccc2c(c1)C(c1ccccn1)=NCc1c(-c3nc(CC)no3)ncn1-2	C22H16N6O	aryldiazepine
+C#Cc1ccc2c(c1)C(c1ccccn1)=NCc1c(-c3nc(C)no3)ncn1-2	C21H14N6O	aryldiazepine
+C#Cc1ccc2c(c1)C(c1ccccc1F)=N[C@H](C)c1c(C(N)=O)ncn1-2	C21H15FN4O	aryldiazepine
+C#Cc1ccc2c(c1)C(c1ccccc1F)=N[C@H](C)c1c(-c3nc(C)no3)ncn1-2	C23H16FN5O	aryldiazepine
+C#Cc1ccc2c(c1)C(c1ccccc1F)=N[C@@H](C)c1c(C(=O)NC)ncn1-2	C22H17FN4O	aryldiazepine
+C#Cc1ccc2c(c1)C(c1ccccn1)=N[C@H](C)c1c(C(=O)NC)ncn1-2	C21H17N5O	aryldiazepine
+CNC(=O)c1ncn2c1CN=C(c1ccccc1F)c1cc(Br)ccc1-2	C19H14BrFN4O	aryldiazepine
+C#Cc1ccc2c(c1)C(c1ccccn1)=N[C@H](C)c1c(C(=O)OCC)ncn1-2	C22H18N4O2	aryldiazepine
+C#Cc1ccc2c(c1)C(c1ccccn1)=NCc1c(C(=O)OCC)ncn1-2	C21H16N4O2	aryldiazepine
+C#Cc1ccc2c(c1)C(c1ccccc1F)=N[C@@H](C)c1c(-c3nc(C)no3)ncn1-2	C23H16FN5O	aryldiazepine
+C#Cc1ccc2c(c1)C(c1ccccn1)=N[C@H](C)c1c(-c3nc(C)no3)ncn1-2	C22H16N6O	aryldiazepine
+C#Cc1ccc2c(c1)C(c1ccccc1F)=NCc1c(-c3nc(C)no3)ncn1-2	C22H14FN5O	aryldiazepine
+Cc1noc(-c2ncn3c2[C@@H](C)N=C(c2ccccn2)c2cc(Br)ccc2-3)n1	C20H15BrN6O	aryldiazepine
+C#Cc1ccc2c(c1)C(c1ccccc1)=NCc1c(C(=O)OCC)ncn1-2	C22H17N3O2	aryldiazepine
+C#Cc1ccc2c(c1)C(c1ccccc1)=NCc1nnc(C)n1-2	C19H14N4	aryldiazepine
+CCOC(=O)c1ncn2c1CN=C(c1ccccc1F)c1cc(Br)ccc1-2	C20H15BrFN3O2	aryldiazepine
+C#Cc1ccc2c(c1)C(c1ccccc1F)=NCc1c(C(=O)OCC)ncn1-2	C22H16FN3O2	aryldiazepine
+C#Cc1ccc2c(c1)C(c1ccccc1F)=NCc1nnc(C)n1-2	C19H13FN4	aryldiazepine
+C#Cc1ccc2c(c1)C(c1ccccc1Cl)=NCc1nnc(C)n1-2	C19H13ClN4	aryldiazepine
+CCc1noc(-c2ncn3c2CN=C(c2ccccc2)c2cc(Br)ccc2-3)n1	C21H16BrN5O	aryldiazepine
+C#Cc1ccc2c(c1)C(c1ccccc1Cl)=NCC(=O)N2C	C18H13ClN2O	aryldiazepine
+C#Cc1ccc2c(c1)C(c1ccccc1F)=NCC(=O)N2	C17H11FN2O	aryldiazepine
+CCOC(=O)c1ncn2c1CN=C(c1ccccc1)c1cc(I)ccc1-2	C20H16IN3O2	aryldiazepine
+C#Cc1ccc2c(c1)C(c1cccs1)=NCC(=O)N2C	C16H12N2OS	aryldiazepine
+C[C@H]1N=C(c2ccccc2F)c2cc(Br)ccc2-n2cnc(C(=O)O)c21	C19H13BrFN3O2	aryldiazepine
+COc1ccc2c(c1)C(=O)N1CCC[C@H]1c1c(C(=O)OC(C)(C)C)ncn1-2	C20H23N3O4	aryldiazepine
+C#Cc1ccc2c(c1)C(c1ccccc1F)=NCC(=O)N2C	C18H13FN2O	aryldiazepine
+C#Cc1ccc2c(c1)C(c1ccccn1)=NCC(=O)N2C	C17H13N3O	aryldiazepine
+C#Cc1ccc2c(c1)C(c1ccccc1F)=NCc1c(C(=O)NC)ncn1-2	C21H15FN4O	aryldiazepine
+C#Cc1ccc2c(c1)C(c1ccccn1)=NCc1c(C(=O)NC)ncn1-2	C20H15N5O	aryldiazepine
+C#Cc1ccc2c(c1)C(c1ccccc1)=NCc1c(C(=O)NC)ncn1-2	C21H16N4O	aryldiazepine
+C#Cc1ccc2c(c1)C(c1ccccc1)=NCc1c(-c3nc(C(C)C)no3)ncn1-2	C24H19N5O	aryldiazepine
+CNC(=O)c1ncn2c1CN(C)C(=O)c1cc(Cl)ccc1-2	C14H13ClN4O2	aryldiazepine
+CN1Cc2c(CF)ncn2-c2ccc(Cl)cc2C1=O	C13H11ClFN3O	aryldiazepine
+C#Cc1ccc2c(c1)C(c1ccccn1)=NCc1c(-c3nc(C(C)C)no3)ncn1-2	C23H18N6O	aryldiazepine
+C#Cc1ccc2c(c1)C(c1ccccc1)=NCc1c(C(=O)OCCCOC(=O)c3ncn4c3CN(C)C(=O)c3cc(Cl)ccc3-4)ncn1-2	C36H27ClN6O5	aryldiazepine
+C#Cc1ccc2c(c1)C(c1ccccn1)=NCc1c(C(=O)O)ncn1-2	C19H12N4O2	aryldiazepine
+C#Cc1ccc2c(c1)C(c1ccccc1F)=NCc1c(C(=O)OCCCOC(=O)c3ncn4c3CN=C(c3ccccc3F)c3cc(C#C)ccc3-4)ncn1-2	C43H28F2N6O4	aryldiazepine
+C#Cc1ccc2c(c1)C(c1ccccn1)=NCc1c(C(=O)SC)ncn1-2	C20H14N4OS	aryldiazepine
+C#Cc1ccc2c(c1)C(c1ccccn1)=NCc1c(C(=O)N(C)C)ncn1-2	C21H17N5O	aryldiazepine
+C#Cc1ccc2c(c1)C(c1ccccc1)=N[C@H](C)c1c(C(=O)OC)ncn1-2	C22H17N3O2	aryldiazepine
+O=C1CN=C(c2cccs2)c2cc(Br)ccc2N1	C13H9BrN2OS	aryldiazepine
+CN1C(=O)CN=C(c2ccccc2)c2cc(Br)ccc21	C16H13BrN2O	aryldiazepine
+Oc1cccc2cc[nH]c12	C8H7NO	unknown
+N[C@@H](Cc1c[nH]c2c(O)cccc12)C(=O)O	C11H12N2O3	tryptamine
+NCCc1c[nH]c2c(O)cccc12	C10H12N2O	tryptamine
+NCCc1c[nH]c2c(OP(=O)(O)O)cccc12	C10H13N2O4P	tryptamine
+CN1C[C@H](CNC(=O)OCc2ccccc2)C[C@@H]2c3cccc4c3c(cn4C)C[C@H]21	C25H29N3O2	unknown
+CC(C)n1cc2c3c(cccc31)[C@H]1C[C@@H](C(=O)NC3CCCCC3)CN(C)[C@@H]1C2	C25H35N3O	unknown
+CCn1cc(CCN)c2ccccc21	C12H16N2	tryptamine
+CCN(CC)C(=O)[C@@H]1CC2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C20H27N3O	unknown
+CCN1C[C@H](C(=O)N(C)C(C)C)C=C2c3cccc4[nH]cc(c34)C[C@H]21	C21H27N3O	unknown
+COc1cc(C)c(OC(C)C)cc1CC(C)N	C14H23NO2	unknown
+C/N=C(\C)Cc1ccccc1	C10H13N	unknown
+CC(Cc1ccccc1)N(C)C=O	C11H15NO	unknown
+CCC(=O)Oc1cccc2[nH]cc(CCN(C)C)c12	C15H20N2O2	tryptamine
+COC1CCCCC1c1ccccc1	C13H18O	unknown
+COC1CCCC(c2ccccc2)C1	C13H18O	unknown
+COC1CCC(c2ccccc2)CC1	C13H18O	unknown
+CCN(CC)CCn1c(Cc2ccc(OC(C)C)cc2)nc2cc([N+](=O)[O-])ccc21	C23H30N4O3	unknown
+O=C1CC[C@@]2(O)[C@H]3Cc4ccc(O)c5c4[C@@]2(CCN3C[C@H]2CCCO2)[C@H]1O5	C21H25NO5	unknown
+Oc1ccc2c(c1)[C@@]13CCCC[C@H]1[C@@H](C2)N(CCc1ccco1)CC3	C22H27NO2	unknown
+CC(c1ccc(Br)cc1)N1CCC(n2c(=O)[nH]c3ccccc32)CC1	C20H22BrN3O	unknown
+CC1CN(C(C)c2ccc(Br)cc2)CCC1n1c(=O)[nH]c2ccccc21	C21H24BrN3O	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)C3CC3)C[C@H]2N(C)C1	C24H29N3O2	unknown
+NC(=O)C(c1ccccc1)C1CCCCN1	C13H18N2O	unknown
+Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1	C24H22N4O2	aryldiazepine
+OC(CCN1CCCCC1)(c1ccccc1)C1CCCCC1	C20H31NO	unknown
+O=C(Nc1ccccc1)N[C@@H]1C(=O)N(CC23CC4CC(CC(C4)C2)C3)c2ccccc2N(c2ccccc2)C1=O	C33H34N4O3	unknown
+CCCN(CCOC)c1cc(C)nc2c(-c3ccc(OC)cc3OC)c(C)nn12	C22H30N4O3	unknown
+COCC(COC)Nc1nc(C)nc2c(-c3ccc(Cl)cc3Cl)c(C)nn12	C18H21Cl2N5O2	unknown
+CCCN(CCC)c1cc(C)nc2c(-c3cnc(N(C)C)cc3C)c(C)nn12	C22H32N6	unknown
+O=C(O)C(c1ccccc1)C1CCCCN1	C13H17NO2	unknown
+COC(=O)C(c1ccc(O)cc1)C1CCCCN1	C14H19NO3	unknown
+O=C(O)C(c1ccc(O)cc1)C1CCCCN1	C13H17NO3	unknown
+C[C@@H]1CN(C(=O)c2cc3c(C(=O)OC(C)(C)C)ncn3c3ccc(Cl)cc23)C[C@H](C)N1	C23H27ClN4O3	unknown
+CN(C)C(=O)c1cc2c(C(=O)OC(C)(C)C)ncn2c2ccccc12	C19H21N3O3	unknown
+CCCCN(C)C(=O)c1cc2c(C(=O)OCC)ncn2c2ccccc12	C20H23N3O3	unknown
+CCCCN(C)C(=O)c1cc2c(C(=O)OC(C)(C)C)ncn2c2ccccc12	C22H27N3O3	unknown
+CCCN(CCC)C(=O)c1cc2c(C(=O)OCC)ncn2c2ccccc12	C21H25N3O3	unknown
+CCCN(CCC)C(=O)c1cc2c(C(=O)OC(C)(C)C)ncn2c2ccccc12	C23H29N3O3	unknown
+CCOC(=O)c1ncn2c1cc(C(=O)N(C)Cc1ccccc1)c1ccccc12	C23H21N3O3	unknown
+CN(Cc1ccccc1)C(=O)c1cc2c(C(=O)OC(C)(C)C)ncn2c2ccccc12	C25H25N3O3	unknown
+CCOC(=O)c1ncn2c1cc(C(=O)N1CCN(C)CC1)c1ccccc12	C20H22N4O3	unknown
+CCOC(=O)c1ncn2c1c(C)c(C(=O)OC(C)(C)C)c1ccccc12	C20H22N2O4	unknown
+CCCN(CCC)C(=O)c1c(C)c2c(C(=O)OCC)ncn2c2ccccc12	C22H27N3O3	unknown
+CCCN(CCC)C(=O)c1c(C)c2c(C(=O)OC(C)(C)C)ncn2c2ccccc12	C24H31N3O3	unknown
+CCOC(=O)c1ncn2c1c(C)c(C(=O)N(C)Cc1ccccc1)c1ccccc12	C24H23N3O3	unknown
+Cc1c(C(=O)N(C)Cc2ccccc2)c2ccccc2n2cnc(C(=O)OC(C)(C)C)c12	C26H27N3O3	unknown
+CCCN(CCC)C(=O)c1c(CC)c2c(C(=O)OCC)ncn2c2ccccc12	C23H29N3O3	unknown
+CCCN(CCC)C(=O)c1c(CC)c2c(C(=O)OC(C)(C)C)ncn2c2ccccc12	C25H33N3O3	unknown
+CCCc1c(C(=O)N(CC)CC)c2ccccc2n2cnc(C(=O)OCC)c12	C22H27N3O3	unknown
+CCCc1c(C(=O)N(CC)CC)c2ccccc2n2cnc(C(=O)OC(C)(C)C)c12	C24H31N3O3	unknown
+CCCc1c(C(=O)N(CCC)CCC)c2ccccc2n2cnc(C(=O)OCC)c12	C24H31N3O3	unknown
+CCCc1c(C(=O)N(CCC)CCC)c2ccccc2n2cnc(C(=O)OC(C)(C)C)c12	C26H35N3O3	unknown
+CCCN(CCC)C(=O)c1cc2c(C(=O)OCC)ncn2c2ccc(F)cc12	C21H24FN3O3	unknown
+CCOC(=O)c1ncn2c1cc(C(=O)N(C)Cc1ccccc1)c1cc(F)ccc12	C23H20FN3O3	unknown
+CCOC(=O)c1ncn2c1cc(C(=O)N(C)Cc1ccccc1)c1cc(Br)ccc12	C23H20BrN3O3	unknown
+CCOC(=O)c1ncn2c1cc(-c1ccccc1)c1ccccc12	C20H16N2O2	unknown
+CC(C)(C)OC(=O)c1ncn2c1cc(-c1ccccc1)c1ccccc12	C22H20N2O2	unknown
+CN(C)C(=O)c1ncn2c1cc(-c1ccccc1)c1ccccc12	C20H17N3O	unknown
+CN(Cc1ccccc1)C(=O)c1ncn2c1cc(-c1ccccc1)c1ccccc12	C26H21N3O	unknown
+Cc1c(-c2ccccc2)c2ccccc2n2cnc(C(=O)OC(C)(C)C)c12	C23H22N2O2	unknown
+Cc1c(-c2ccccc2)c2ccccc2n2cnc(C(=O)N(C)Cc3ccccc3)c12	C27H23N3O	unknown
+CCOC(=O)c1ncn2c1c(C(=O)OCC)c(-c1ccccc1)c1ccccc12	C23H20N2O4	unknown
+CCOC(=O)Cc1c(-c2ccccc2)c2ccccc2n2cnc(C(=O)OCC)c12	C24H22N2O4	unknown
+CCOC(=O)c1ncn2c1c(CO)c(-c1ccccc1)c1ccccc12	C21H18N2O3	unknown
+O=C1CCCCC1(NCCCO)c1ccccc1Cl	C15H20ClNO2	unknown
+CCOC(=O)c1ncn2c1CN(C(C)=O)c1ccccc1-2	C15H15N3O3	unknown
+CC(=O)N1Cc2c(C(=O)OC(C)(C)C)ncn2-c2ccccc21	C17H19N3O3	unknown
+CCOC(=O)c1ncn2c1CN(C(C)=O)c1cc(F)ccc1-2	C15H14FN3O3	unknown
+CC(=O)N1Cc2c(C(=O)OC(C)(C)C)ncn2-c2ccc(F)cc21	C17H18FN3O3	unknown
+COc1c(-n2c(C)nc3ccccc3c2=O)cccc1[N+](=O)[O-]	C16H13N3O4	unknown
+COc1cc([N+](=O)[O-])ccc1-n1c(C)nc2ccccc2c1=O	C16H13N3O4	unknown
+COc1ccc([N+](=O)[O-])cc1-n1c(C)nc2ccccc2c1=O	C16H13N3O4	unknown
+COc1cccc([N+](=O)[O-])c1-n1c(C)nc2ccccc2c1=O	C16H13N3O4	unknown
+CC(=O)N(c1cccc(C)c1)C1CCN(CCc2ccccc2)CC1	C22H28N2O	fentanyl
+CC(=O)N(c1ccccc1)C1CCN(CCc2ccccc2C)CC1	C22H28N2O	fentanyl
+CC(=O)N(c1ccccc1)C1CCN(CCc2cccc(C)c2)CC1	C22H28N2O	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CCc2ccccc2C)CC1	C23H30N2O	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CCc2cccc(C)c2)CC1	C23H30N2O	fentanyl
+CC(=O)N(c1ccccc1)C1CCN(CC(C)c2ccccc2)CC1	C22H28N2O	fentanyl
+CC(=O)N(c1cccc(F)c1)C1CCN(CCc2ccccc2)CC1	C21H25FN2O	fentanyl
+CC(=O)N(c1ccccc1)C1CCN(CCc2ccccc2)CC1C	C22H28N2O	fentanyl
+CCOC(=O)CCNC1(c2ccccc2Cl)CCCCC1=O	C17H22ClNO3	arylcycloalkylamine
+CCCCCn1cc(C(=O)Cc2ccc(F)cc2)c2ccccc21	C21H22FNO	cannabinoid
+CC(=O)OCCCNC1(c2ccccc2Cl)CCCCC1=O	C17H22ClNO3	arylcycloalkylamine
+CCOC(=O)CCCNC1(c2ccccc2Cl)CCCCC1=O	C18H24ClNO3	arylcycloalkylamine
+CCCOC(=O)CCCNC1(c2ccccc2Cl)CCCCC1=O	C19H26ClNO3	arylcycloalkylamine
+CCOC(=O)CCCCNC1(c2ccccc2Cl)CCCCC1=O	C19H26ClNO3	arylcycloalkylamine
+CC(C)OC(=O)CCCCNC1(c2ccccc2Cl)CCCCC1=O	C20H28ClNO3	arylcycloalkylamine
+CCCOC(=O)CCCCNC1(c2ccccc2Cl)CCCCC1=O	C20H28ClNO3	arylcycloalkylamine
+CN(C)C1(c2ccccc2Cl)CCCCC1=O	C14H18ClNO	arylcycloalkylamine
+CCOC(=O)CCN(C)C1(c2ccccc2Cl)CCCCC1=O	C18H24ClNO3	arylcycloalkylamine
+COC(=O)CCCCN(C)C1(c2ccccc2Cl)CCCCC1=O	C19H26ClNO3	arylcycloalkylamine
+C/C(Cc1ccc2c(c1)OCO2)=N\O	C10H11NO3	unknown
+CC(O)Cc1ccc2c(c1)OCO2	C10H12O3	unknown
+CC(=O)NC(C)Cc1ccc2c(c1)OCO2	C12H15NO3	unknown
+CC(=O)ON(C(C)=O)C(C)Cc1ccc2c(c1)OCO2	C14H17NO5	unknown
+CC(=O)O/N=C(\C)Cc1ccc2c(c1)OCO2	C12H13NO4	unknown
+COc1ccc(C(=O)c2cn(CC3CCCCC3)c3ccccc23)c2ccccc12	C27H27NO2	cannabinoid
+CCOC(=O)c1ncn2c1CN=C(c1ccc([N+](=O)[O-])cc1)c1cc(F)ccc1-2	C20H15FN4O4	aryldiazepine
+CCOC(=O)c1ncn2c1CN=C(c1ccc(Cl)cc1)c1ccc3ccccc3c1-2	C24H18ClN3O2	aryldiazepine
+CCOC(=O)c1ncn2c1CN=C(c1ccc(F)cc1)c1ccccc1-2	C20H16FN3O2	aryldiazepine
+CCOC(=O)c1ncn2c1CN=C(c1ccc(Cl)cc1)c1ccccc1-2	C20H16ClN3O2	aryldiazepine
+CCOC(=O)c1ncn2c1CN=C(c1ccc(C)cc1)c1ccccc1-2	C21H19N3O2	aryldiazepine
+CCOC(=O)c1ncn2c1CN=C(c1ccc(OC)cc1)c1ccccc1-2	C21H19N3O3	aryldiazepine
+CCOC(=O)c1ncn2c1C(C)N=C(c1ccccc1)c1ccccc1-2	C21H19N3O2	aryldiazepine
+CCOC(=O)c1ncn2c1CN=C(c1ccc(F)cc1)c1cc(F)ccc1-2	C20H15F2N3O2	aryldiazepine
+CCOC(=O)c1ncn2c1CN=C(c1ccc(F)cc1)c1cc(Cl)ccc1-2	C20H15ClFN3O2	aryldiazepine
+CCOC(=O)c1ncn2c1CN=C(c1ccc(Cl)cc1)c1cc(Cl)ccc1-2	C20H15Cl2N3O2	aryldiazepine
+CCOC(=O)c1ncn2c1CN=C(c1ccc(C)cc1)c1cc(Cl)ccc1-2	C21H18ClN3O2	aryldiazepine
+CCOC(=O)c1ncn2c1CN=C(c1ccc(OC)cc1)c1cc(Cl)ccc1-2	C21H18ClN3O3	aryldiazepine
+CCOC(=O)c1ncn2c1CN=C(c1cccc([N+](=O)[O-])c1)c1cc(Cl)ccc1-2	C20H15ClN4O4	aryldiazepine
+CCOC(=O)c1ncn2c1CN=C(c1cccc3ccccc13)c1cc(Cl)ccc1-2	C24H18ClN3O2	aryldiazepine
+CC(C)(C)OC(=O)c1ncn2c1CN=C(c1ccc(Cl)cc1)c1cc(Cl)ccc1-2	C22H19Cl2N3O2	aryldiazepine
+NC(=O)c1ncn2c1CN=C(c1ccc(Cl)cc1)c1cc(Cl)ccc1-2	C18H12Cl2N4O	aryldiazepine
+CNC(=O)c1ncn2c1CN=C(c1ccc(Cl)cc1)c1cc(Cl)ccc1-2	C19H14Cl2N4O	aryldiazepine
+CN(C)C(=O)c1ncn2c1CN=C(c1ccc(Cl)cc1)c1cc(Cl)ccc1-2	C20H16Cl2N4O	aryldiazepine
+Clc1ccc(C2=NCc3c(-c4nnn[nH]4)ncn3-c3ccc(Cl)cc32)cc1	C18H11Cl2N7	aryldiazepine
+COC(=O)[C@H]1C2CCC(C[C@@H]1c1ccccc1)N2C	C16H21NO2	unknown
+CN1C2CCC1[C@@H](C(=O)O)[C@@H](c1ccccc1)C2	C15H19NO2	unknown
+CN1C2CCC1[C@@H](C(=O)Cl)[C@@H](c1ccccc1)C2	C15H18ClNO	unknown
+Cc1noc([C@H]2C3CCC(C[C@@H]2c2ccccc2)N3C)n1	C17H21N3O	unknown
+CC1C(c2ccccc2)N1C	C10H13N	unknown
+C[N+]1([O-])CC[C@]23c4c5ccc(O)c4O[C@H]2[C@@H](O)C=C[C@H]3[C@H]1C5	C17H19NO4	unknown
+CC(=O)Oc1ccc2c3c1O[C@H]1[C@@H](OC(C)=O)C=C[C@H]4[C@@H](C2)[N+](C)=CC[C@@]341.CC(=O)[O-]	C21H22NO5.C2H4O2	unknown
+CC(=O)Oc1ccc2c3c1O[C@H]1[C@@H](OC(C)=O)C=C[C@H]4[C@@H](C2)N(C)C=C[C@@]341	C21H21NO5	unknown
+CC(N)Cc1c2c(cc3c1OCO3)OCO2	C11H13NO4	unknown
+Cc1c2c(c(CC(C)N)c3c1OCO3)OCO2	C12H15NO4	unknown
+CCNC1(c2ccccc2)CCCC1C	C14H21N	arylcycloalkylamine
+CCNC1(c2ccccc2)CCC(C)C1	C14H21N	arylcycloalkylamine
+CC(OC=O)C(O)c1ccccc1	C10H12O3	unknown
+CC(O)C(OC=O)c1ccccc1	C10H12O3	unknown
+CC1=CC2=NC(C)CC2=CC1=O	C10H11NO	unknown
+COc1cc2c(CCN(C)C)c[nH]c2c(OC)c1OC	C15H22N2O3	tryptamine
+COc1cc2c(cc1OC)C(c1ccccc1)CN(C)CC2	C19H23NO2	unknown
+CCOC(=O)c1ncn2c1c1c(c3ccccc32)CCC1	C17H16N2O2	unknown
+CC(C)OC(=O)CCCNC1(c2ccccc2Cl)CCCCC1=O	C19H26ClNO3	arylcycloalkylamine
+CC(C)OC(=O)CCNC1(c2ccccc2Cl)CCCCC1=O	C18H24ClNO3	arylcycloalkylamine
+CCCCn1cc(C(=O)c2cccc(OC)c2)c2ccccc21	C20H21NO2	cannabinoid
+CCOC(=O)c1cncn1[C@H](C)c1ccccc1	C14H16N2O2	unknown
+COC(=O)CCOC(=O)c1cncn1[C@H](C)c1ccccc1	C16H18N2O4	unknown
+C[C@H](c1ccccc1)n1cncc1C(=O)OCCC(=O)O	C15H16N2O4	unknown
+CCOC(=O)c1ncn2c1CN=C(c1ccccc1)c1ccccc1-2	C20H17N3O2	aryldiazepine
+CCOC(=O)c1ncn2c1CN=C(c1ccccc1)c1cc(Cl)ccc1-2	C20H16ClN3O2	aryldiazepine
+CN1CC[Si@]23CCCC[C@H]2[C@H]1Cc1ccc(O)cc13	C16H23NOSi	prophetic
+CCc1noc(C2(c3cccc(O)c3)CCN(C)CC2)n1	C16H21N3O2	prophetic
+CCC(=O)O[C@@]1(c2ccccc2)CCC[C@@H]1NC	C15H21NO2	unknown
+O=c1[nH]c2ccccc2n1C1CCN(CCc2ccccc2)CC1	C20H23N3O	unknown
+O=C(N1CCCC1)N(c1ccccc1)C1CCN(CCc2ccccc2)CC1	C24H31N3O	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(C(C)c2ccc(Br)cc2)CC1	C22H27BrN2O	prophetic
+CN1CC[C@]2(c3cccc(O)c3)CCCC[C@@]2(O)C1	C16H23NO2	prophetic
+O=C(N1CCCC1)C(CCN1CCC(n2c(=O)[nH]c3ccccc32)CC1)(c1ccccc1)c1ccccc1	C32H36N4O2	prophetic
+CCC(=O)C(CCN1CCC(n2c(=O)[nH]c3ccccc32)CC1)(c1ccccc1)c1ccccc1	C30H33N3O2	unknown
+O=C(c1ccccc1)C(C1CCCC1)N1CCCC1	C17H23NO	beta-ketone
+O=C(c1ccccc1)C(C1CCCCC1)N1CCCC1	C18H25NO	beta-ketone
+C[C@@H](Cc1ccsc1)NC(=O)NC[C@H](Cc1ccc(O)cc1)N(C)C	C19H27N3O2S	unknown
+COc1ccsc1CNCC[C@@]1(c2ccccn2)CCOC2(CCCC2)C1	C22H30N2O2S	unknown
+C=CCN1C[C@H](C)N([C@@H](c2cccc(O)c2)c2cccc(C(=O)N(C)c3cccc(F)c3)c2)C[C@H]1C	C30H34FN3O2	unknown
+CNC1(c2ccccc2I)CCCCC1=O	C13H16INO	arylcycloalkylamine
+CNC1(c2cccc(O)c2)CCCCC1=O	C13H17NO2	arylcycloalkylamine
+CCNC1(c2cccc(O)c2)CCCCC1=O	C14H19NO2	arylcycloalkylamine
+CCOC(=O)C1=NN(c2ccc(Cl)cc2)C(C(=O)OCC)=NN1c1ccc(Cl)cc1	C20H18Cl2N4O4	cannabinoid
+CC1(C)Oc2cc(C34CC5CC(CC(C5)C3)C4)cc(O)c2-c2cc(CO)ccc21	C26H30O3	cannabinoid
+CCCCOC(=O)C(C)(C)c1cc(O)c2c(c1)OC(C)(C)[C@@H]1CC=C(O)C[C@@H]21	C23H32O5	cannabinoid
+CCCCCCC(C)(C)c1cc(O)c2c(c1)OC(C)(C)[C@@H]1CCC(=O)OC[C@@H]21	C24H36O4	cannabinoid
+Cc1c(C(=O)c2cccc(Cl)c2Cl)c2ccsc2n1CC1CCCCN1C	C21H22Cl2N2OS	cannabinoid
+CNC(=O)[C@@H](NC(=O)c1nn(-c2ccc(F)cc2F)c2c1C[C@@H]1C[C@H]21)C(C)(C)C	C21H24F2N4O2	cannabinoid
+CCCNc1cnn(C2CC(C)(C)CC(C)(C)C2)c(=O)c1Br	C17H28BrN3O	cannabinoid
+CC(C)(NC(=O)C1=NN(c2ccc(F)cc2F)C2C1[C@@H]1CC[C@H]2C1)c1ccccc1	C24H25F2N3O	cannabinoid
+O=C(c1cnc(Nc2cccc(Cl)c2)c2c1CCCC2)N1CCOCC1	C20H22ClN3O2	cannabinoid
+CCCCCC(C)(C)c1ccc(-c2cc(C)cc(C)c2)c(O)c1	C22H30O	cannabinoid
+CC1(C)CCc2sc(NC(=O)c3ccccc3Cl)c(C(=O)NCC3CC3)c21	C21H23ClN2O2S	cannabinoid
+O=C(c1ccc2c(c1)c1ccccc1n2CC1CCOCC1)N1CCCCC1	C24H28N2O2	cannabinoid
+COC(=O)C(C)(C)NC(=O)c1cc2c(n(CC3CCCCC3)c1=O)CCCCCC2	C24H36N2O4	cannabinoid
+CCCCn1cc(-c2ccc3ccccc3c2)c2cccc(OC)c21	C23H23NO	cannabinoid
+c1ccc2c(c1)c(OCC1CCCCC1)nn2CC1CCCCC1	C21H30N2O	cannabinoid
+COc1cc(NC(=O)C(=O)c2c(C)n(Cc3ncc(C)s3)c3ccccc23)ccn1	C22H20N4O3S	cannabinoid
+Cc1ccc2c(C(C[N+](=O)[O-])c3cccs3)c(-c3ccccc3)[nH]c2c1	C21H18N2O2S	cannabinoid
+COc1cccc(C2(N3CCCCC3)CCC(=O)CC2)c1	C18H25NO2	arylcycloalkylamine
+Cn1cc(-c2noc(C3CN4CCC3CC4)n2)c2ccccc21	C18H20N4O	unknown
+O=[N+]([O-])CC(c1ccccc1)c1c(-c2ccccc2)[nH]c2ccccc12	C22H18N2O2	cannabinoid
+Fc1cccc(C(Cc2ccccc2)N2CCCC2)c1	C18H20FN	unknown
+Fc1ccc(C(Cc2ccccc2)N2CCCC2)cc1	C18H20FN	unknown
+Fc1cccc(CC(c2ccccc2)N2CCCC2)c1	C18H20FN	unknown
+Fc1ccc(CC(c2ccccc2)N2CCCC2)cc1	C18H20FN	unknown
+Fc1ccccc1CC(c1ccccc1)N1CCCC1	C18H20FN	unknown
+CN(CCc1c[nH]c2cccc(O)c12)CC(F)F	C13H16F2N2O	prophetic,tryptamine
+CCN(CCc1c[nH]c2cccc(O)c12)CC(F)(F)F	C14H17F3N2O	prophetic,tryptamine
+CC1COCC(C)N1CCc1c[nH]c2cccc(O)c12	C16H22N2O2	prophetic,tryptamine
+CCC(N)Cc1c[nH]c2cccc(O)c12	C12H16N2O	tryptamine
+CC(CN)c1c[nH]c2cccc(O)c12	C11H14N2O	prophetic,tryptamine
+CC(C)NCCc1c[nH]c2cccc(O)c12	C13H18N2O	prophetic,tryptamine
+C=CCNCCc1c[nH]c2cccc(O)c12	C13H16N2O	prophetic,tryptamine
+CCC(C)NCCc1c[nH]c2cccc(O)c12	C14H20N2O	prophetic,tryptamine
+CC(C)(C)NCCc1c[nH]c2cccc(O)c12	C14H20N2O	prophetic,tryptamine
+Oc1cccc2[nH]cc(CCNC3CCC3)c12	C14H18N2O	prophetic,tryptamine
+COc1cccc(CNCCc2c[nH]c3cccc(O)c23)c1	C18H20N2O2	prophetic,tryptamine
+NC1CCC1c1c[nH]c2cccc(O)c12	C12H14N2O	prophetic
+CCC(C)N(CCc1c[nH]c2cccc(O)c12)C(C)C	C17H26N2O	prophetic,tryptamine
+CCN(CCc1c[nH]c2cccc(O)c12)C(C)C	C15H22N2O	prophetic,tryptamine
+CN(CCc1c[nH]c2cccc(O)c12)C1CCC1	C15H20N2O	prophetic,tryptamine
+CCCCN(CCC)CCc1c[nH]c2cccc(O)c12	C17H26N2O	prophetic,tryptamine
+CCCN(CCc1c[nH]c2cccc(O)c12)C(C)C	C16H24N2O	prophetic,tryptamine
+CCN1CCCC1Cc1c[nH]c2cccc(O)c12	C15H20N2O	prophetic
+CC1CCC(C)N1CCc1c[nH]c2cccc(O)c12	C16H22N2O	prophetic,tryptamine
+CCN(CCc1c[nH]c2cccc(O)c12)C1CC1	C15H20N2O	prophetic,tryptamine
+CN(CCc1c[nH]c2cccc(O)c12)CC1CC1	C15H20N2O	prophetic,tryptamine
+C=CCN(CC)CCc1c[nH]c2cccc(O)c12	C15H20N2O	prophetic,tryptamine
+C=CCN(CCc1c[nH]c2cccc(O)c12)C(C)C	C16H22N2O	prophetic,tryptamine
+COCCN(C)CCc1c[nH]c2cccc(O)c12	C14H20N2O2	prophetic,tryptamine
+CN(CCc1c[nH]c2cccc(O)c12)C1COC1	C14H18N2O2	prophetic,tryptamine
+Oc1cccc2[nH]cc(CCN(C3CCC3)C3CCC3)c12	C18H24N2O	prophetic,tryptamine
+CCCCCN1N=C(C(=O)NC2C3CC4CC(C3)CC2C4)CC1c1ccccc1	C25H35N3O	cannabinoid
+O=c1c(-c2cccc(C(F)(F)F)c2Cl)nn(Cc2ccc(F)cc2F)c2ccccc12	C22H12ClF5N2O	cannabinoid
+CC(C)[C@H]1CC[C@@H](N2CCC3(CC2)C(=O)N(CCNS(N)(=O)=O)Cc2ccccc23)CC1	C24H38N4O3S	unknown
+Cc1onc(O)c1CC(N)C(=O)O	C7H10N2O4	unknown
+O=C1CCN(CCc2ccccc2)CC1	C13H17NO	unknown
+NC(=O)c1ccc2c(c1O)[C@]13CCN(CC4CC4)[C@H](C2)[C@]1(O)CCC(=O)C3	C21H26N2O4	unknown
+Cc1cc(Cl)ccc1-n1c(C)nc2cccc(Cl)c2c1=O	C16H12Cl2N2O	unknown
+OC1CCN(C2(c3cccs3)CCCCC2)CC1	C15H23NOS	arylcycloalkylamine
+OC1(c2ccccc2)CCN(C2(c3cccs3)CCCCC2)CC1	C21H27NOS	arylcycloalkylamine
+CC(=O)OC1CCN(C2(c3cccs3)CCCCC2)CC1	C17H25NO2S	arylcycloalkylamine
+CCC(=O)OC1CCN(C2(c3cccs3)CCCCC2)CC1	C18H27NO2S	arylcycloalkylamine
+CC(=O)OC1(c2ccccc2)CCN(C2(c3cccs3)CCCCC2)CC1	C23H29NO2S	arylcycloalkylamine
+CCC(=O)OC1(c2ccccc2)CCN(C2(c3cccs3)CCCCC2)CC1	C24H31NO2S	arylcycloalkylamine
+O=C(OC1CCN(C2(c3cccs3)CCCCC2)CC1)c1ccccc1	C22H27NO2S	arylcycloalkylamine
+NCCc1c2c(c(CC(=O)O)c3c1OCC3)OCC2	C14H17NO4	unknown
+NCCc1c2c(c(CCO)c3c1OCC3)OCC2	C14H19NO3	unknown
+NCCc1c2c(c(S)c3c1OCC3)OCC2	C12H15NO2S	unknown
+NCCc1c2c(c(SCCC(=O)O)c3c1OCC3)OCC2	C15H19NO4S	unknown
+NCCc1c2c(c(SCCCO)c3c1OCC3)OCC2	C15H21NO3S	unknown
+CCCS(=O)c1c2c(c(CCN)c3c1OCC3)OCC2	C15H21NO3S	unknown
+CCCS(=O)(=O)c1c2c(c(CCN)c3c1OCC3)OCC2	C15H21NO4S	unknown
+COc1ccc(OC)c(/C=N/CCc2cc(OC)c(Br)cc2OC)c1	C19H22BrNO4	unknown
+COc1ccc(OC)c(/C=N/CCc2cc(OC)ccc2OC)c1	C19H23NO4	unknown
+CCC(Cc1cc(OC)c(Br)cc1OC)/N=C/c1cc(OC)ccc1OC	C21H26BrNO4	unknown
+CN(C)CCc1c[nH]c2c1C(=O)C=CC2=O	C12H14N2O2	unknown
+CN(C)CCc1c[nH]c2c1C(=O)C(=O)C=C2	C12H14N2O2	unknown
+O=C(c1ccccc1)C1CCCNC1	C12H15NO	unknown
+c1ccc(CC2CCCNC2)cc1	C12H17N	unknown
+Cc1ccc(C(=O)C2CCCNC2)cc1	C13H17NO	unknown
+CCc1ccc(C(=O)C2CCCNC2)cc1	C14H19NO	unknown
+O=C(c1ccc(Cl)cc1)C1CCCNC1	C12H14ClNO	unknown
+O=C(c1ccc(Br)cc1)C1CCCNC1	C12H14BrNO	unknown
+COc1ccc(C(=O)C2CCCNC2)cc1	C13H17NO2	unknown
+O=C(c1ccc(C(F)(F)F)cc1)C1CCCNC1	C13H14F3NO	unknown
+O=C(c1ccc(Cl)c(Cl)c1)C1CCCNC1	C12H13Cl2NO	unknown
+COc1cc2c(cc1CC(C)N)SCO2	C11H15NO2S	unknown
+COCc1c(OC)cc(CCN)cc1OC	C12H19NO3	unknown
+CN1CCC(N(C(=O)c2ccco2)c2ccccc2)CC1	C17H20N2O2	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CCc2ccc(OC)c(OC)c2)CC1	C24H32N2O3	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CCc2cccc(OC)c2OC)CC1	C24H32N2O3	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CCc2cc(OC)ccc2OC)CC1	C24H32N2O3	fentanyl
+O=C(CC1CC1)N(c1ccccc1)C1CCN(CCc2ccccc2)CC1	C24H30N2O	fentanyl
+CCCCOc1ccc(C(=O)c2cccc3ccccc23)c2ccccc12	C25H22O2	cannabinoid
+CCCCCCOc1ccc(C(=O)c2cccc3ccccc23)c2ccccc12	C27H26O2	cannabinoid
+CCS(=O)(=O)Nc1ccc2c(c1)nc(C(C)(C)C)n2CC1CCC(F)(F)CC1	C20H29F2N3O2S	cannabinoid
+C=CCn1c2c(c3cc(C(=O)N4CCC(C)CC4)ccc31)CN(CC1CC1)CC2	C25H33N3O	cannabinoid
+C=CCn1c2c(c3cc(C(=O)N4CCC(C)CC4)ccc31)CN(C1CCCC1)CC2	C26H35N3O	cannabinoid
+C=CCn1c2c(c3cc(C(=O)N4CCC(C)CC4)ccc31)CN(C1CCOCC1)CC2	C26H35N3O2	cannabinoid
+CCCn1c2c(c3cc(C(=O)N4CCC(C)CC4)ccc31)CN(C1CCOCC1)CC2	C26H37N3O2	cannabinoid
+CCCC(=O)n1c2c(c3cc(C(=O)N4CCC(C)CC4)ccc31)CN(C1CCOCC1)CC2	C27H37N3O3	cannabinoid
+CCCS(=O)(=O)n1c2c(c3cc(C(=O)N4CCC(C)CC4)ccc31)CN(C1CCOCC1)CC2	C26H37N3O4S	cannabinoid
+CCS(=O)(=O)n1c2c(c3cc(C(=O)N4CCC(C)CC4)ccc31)CN(C1CCOCC1)CC2	C25H35N3O4S	cannabinoid
+CC1CCN(C(=O)c2ccc3c(c2)c2c(n3S(C)(=O)=O)CCN(C3CCOCC3)C2)CC1	C24H33N3O4S	cannabinoid
+CCNS(=O)(=O)n1c2c(c3cc(C(=O)N4CCC(C)CC4)ccc31)CN(C1CCOCC1)CC2	C25H36N4O4S	cannabinoid
+CN(CC(N)=O)Cc1nc(-c2cn(CC3CCS(=O)(=O)CC3)c3c(Cl)cccc23)no1	C20H24ClN5O4S	cannabinoid
+CN(CC(=O)NCCO)Cc1nc(-c2cn(CC3CCOCC3)c3c(Cl)cccc23)no1	C22H28ClN5O4	cannabinoid
+CC(=O)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C	C21H32O2	unknown
+CCCCC[C@H](O)/C=C/C=C\C=C\C=C\[C@@H](O)[C@@H](O)CCCC(=O)O	C20H32O5	unknown
+O=C(Nc1ccc(Cl)cc1)Nc1cccc(-c2cccc(N3CCCC3)n2)c1	C22H21ClN4O	cannabinoid
+CCCCCNc1ccc(C(=O)c2cccc3ccccc23)c2ccccc12	C26H25NO	cannabinoid
+CN(CC(N)=O)Cc1nc(-c2cn(CC3CCOCC3)c3c(Cl)cccc23)ns1	C20H24ClN5O2S	cannabinoid
+CCC(=O)N(c1ccccc1)C1CCN(C(C)C(=O)OC(C)(C)C)CC1	C21H32N2O3	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CCC#N)CC1	C17H23N3O	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CCCOc2ccccc2)CC1	C23H30N2O2	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CCC(=O)NC(C)C)CC1	C20H31N3O2	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CCC(=O)NC(C)(C)C)CC1	C21H33N3O2	fentanyl
+COc1cc(CCN)cc(OC)c1OC1CCCC1	C15H23NO3	unknown
+CCc1cc(OC)c(CC2(N)CC2)cc1OC	C14H21NO2	unknown
+COc1cc(C=O)ccc1OCc1ccccc1	C15H14O3	unknown
+CN(C)[C@@H](Cc1c[nH]c2ccccc12)C(=O)O	C13H16N2O2	tryptamine
+COc1cc(CCNCc2ccccc2)c(OC)cc1Cl	C17H20ClNO2	unknown
+CCOc1ccccc1CNCCc1cc(OC)c(Cl)cc1OC	C19H24ClNO3	unknown
+COc1cc(CCNCc2ccccc2OC(C)C)c(OC)cc1Cl	C20H26ClNO3	unknown
+COc1ccccc1CNCCc1ccc2c(c1)OCO2	C17H19NO3	unknown
+COc1cc(CCNCC(=O)N2CCCCC2)c(OC)cc1Br	C17H25BrN2O3	unknown
+CC(N)Cc1coc2ccccc12	C11H13NO	unknown
+CCC(Cc1ccc2ccoc2c1)NC	C13H17NO	unknown
+COc1cc2c(cc1CC(C)N)CCO2	C12H17NO2	unknown
+NCCc1c2c(c(Cl)c3c1OCC3)OCC2	C12H14ClNO2	unknown
+CCOc1ccc2[nH]cc(CC(C)N)c2c1	C13H18N2O	tryptamine
+CC(C)N(C(C)C)C(C)Cc1c[nH]c2ccccc12	C17H26N2	tryptamine
+CCC(N)Cc1c[nH]c2ccc(F)cc12	C12H15FN2	tryptamine
+CCC(N)Cc1c[nH]c2ccc(C)cc12	C13H18N2	tryptamine
+CN1CCCC1Cc1c[nH]c2ccccc12	C14H18N2	tryptamine
+CN1CCCC1Cc1c[nH]c2ccc(F)cc12	C14H17FN2	unknown
+CN1CCCC1Cc1c[nH]c2ccc(Br)cc12	C14H17BrN2	unknown
+CN1CCCC1Cc1c[nH]c2ccc(CCS(=O)(=O)c3ccccc3)cc12	C22H26N2O2S	unknown
+CCCNC1(c2cccc(O)c2)CCCCC1	C15H23NO	unknown
+Fc1ccc(C2(N3CCCC3)CCCCC2)cc1	C16H22FN	unknown
+CNC1(c2cccc(C)c2)CCCCC1=O	C14H19NO	arylcycloalkylamine
+CNC1(c2ccccc2Cl)CCC(=O)CC1	C13H16ClNO	arylcycloalkylamine
+CCNC1(c2cccs2)CCCCC1	C12H19NS	unknown
+Oc1ccc(C(O)C2CCCCN2)cc1O	C12H17NO3	unknown
+CC(C)CC(c1cccc(Cl)c1)C1CCCCN1	C16H24ClN	unknown
+CN1CCCC(O)C1C(c1ccccc1)c1ccccc1	C19H23NO	unknown
+OCCN1CCCCC1C(c1ccccc1)c1ccccc1	C20H25NO	unknown
+COC(=O)C(c1ccc2ccccc2c1)C1CCCN1	C17H19NO2	unknown
+OC1C2CCN(CC2)C1C(c1ccccc1)c1ccc(Cl)cc1	C20H22ClNO	unknown
+Cc1cc(OP(=O)(O)O)c2c(CCN(C)C)c[nH]c2c1	C13H19N2O4P	tryptamine
+CNCCc1c[nH]c2cc(C)cc(OP(=O)(O)O)c12	C12H17N2O4P	tryptamine
+Cc1cc(O)c2c(C[C@H](N)C(=O)O)c[nH]c2c1	C12H14N2O3	tryptamine
+CC[C@@H]1CN2CC[C@@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC	C22H28N2O4	unknown
+CC[C@@H]1CN2CC[C@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC	C22H28N2O4	unknown
+CC[C@@H]1CN2CCc3c([nH]c4ccccc34)[C@H]2C[C@@H]1/C(=C\OC)C(=O)OC	C22H28N2O3	unknown
+C[C@]12CC[C@H](O)C[C@H]1CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](c3ccc(=O)oc3)C[C@H]3O[C@]132	C24H32O4	unknown
+C[C@]12CC[C@H]3[C@@H](CC[C@]4(O)C[C@@H](O)CC[C@]34C=O)[C@@]1(O)CC[C@@H]2c1ccc(=O)oc1	C24H32O6	unknown
+COc1ccc2[nH]cc(CCO)c2c1	C11H13NO2	unknown
+OCCc1c[nH]c2ccc(O)cc12	C10H11NO2	unknown
+CCC(=O)N(c1ccccc1)C(CC=O)CCNCCc1ccccc1	C22H28N2O2	unknown
+CCC(=O)N(c1ccccc1)C1CC[N+]([O-])(CCc2ccccc2)CC1	C22H28N2O2	fentanyl
+O=C(c1cn(CCCCCF)c2ccccc12)N1CCCCC1	C19H25FN2O	unknown
+O=C(c1cn(CCCCCF)c2ccccc12)N1CCCCCC1	C20H27FN2O	unknown
+CCN(CC)C(=O)c1cn(CCCCCF)c2ccccc12	C18H25FN2O	unknown
+CN(C)C(=O)c1cn(CCCCCF)c2ccccc12	C16H21FN2O	unknown
+CCCCn1cc(C(=O)N2CCCC2)c2ccccc21	C17H22N2O	unknown
+CCCCCn1cc(C(=O)N2CCCC2)c2ccccc21	C18H24N2O	unknown
+O=C(c1cn(Cc2ccc(F)cc2)c2ccccc12)N1CCCC1	C20H19FN2O	unknown
+O=C(c1cn(CC2CCCCC2)c2ccccc12)N1CCCC1	C20H26N2O	unknown
+CC1C(c2cccc(F)c2)OCCN1O	C11H14FNO2	unknown
+CC(N)C(O)c1cccc(F)c1	C9H12FNO	unknown
+c1cnc2cc[nH]c2c1	C7H6N2	unknown
+c1cc2[nH]ccc2cn1	C7H6N2	unknown
+c1cc2cc[nH]c2cn1	C7H6N2	unknown
+c1cnc2[nH]ccc2c1	C7H6N2	unknown
+CCN1CCc2c([nH]c3ccc(OC)cc23)N=C1C1CCCCC1	C20H27N3O	unknown
+CCCC[C@H]1Cc2[nH]c3ccc(OC)cc3c2CCN1	C17H24N2O	unknown
+COc1ccc2[nH]c3c(c2c1)C[C@H](C1CCCCC1)NC3	C18H24N2O	unknown
+COc1ccc2[nH]c3c(c2c1)CCN=C3N	C12H13N3O	unknown
+CC[C@@H](C)C(C)(C)c1cc(OC)c2c(c1)OC(C)(C)[C@@H]1CC=C(C)C[C@@H]21	C24H36O2	cannabinoid
+CCC(=O)N(c1ccn(-c2ccccc2)n1)C1CCN(CCc2ccccc2)CC1	C25H30N4O	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CCc2cc(OC)c(Br)cc2OC)CC1	C24H31BrN2O3	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(C(C)Cc2ccc3c(c2)OCO3)CC1	C24H30N2O3	fentanyl
+CCOc1cc(SCC)c(OC)cc1C=O	C12H16O3S	unknown
+c1ccc2c3c([nH]c2c1)[C@@H]1C[C@H]2CC[C@@H]1N(CC3)C2	C17H20N2	unknown
+CC[C@H]1C[C@@H]2C[C@H]3c4[nH]c5ccccc5c4CCN(C2)[C@@H]13	C19H24N2	unknown
+CC[C@@H]1C[C@@H]2C[C@H]3c4[nH]c5ccccc5c4CCN(C2)[C@@H]13	C19H24N2	unknown
+CC[C@@H]1C[C@@H]2C[C@H]3c4[nH]c5ccc(OC)cc5c4CCN(C2)[C@@H]13	C20H26N2O	unknown
+CC[C@H]1C[C@@H]2C[C@H]3c4[nH]c5cc(OC)ccc5c4CCN(C2)[C@@H]13	C20H26N2O	unknown
+CC[C@H]1C[C@@H]2C[C@H]3c4oc5ccccc5c4CCN(C2)[C@@H]13	C19H23NO	unknown
+CC[C@@H]1C[C@@H]2C[C@H]3c4oc5ccccc5c4CCN(C2)[C@@H]13	C19H23NO	unknown
+CC[C@H]1C[C@@H]2C[C@H]3c4oc5ccc(OC)cc5c4CCN(C2)[C@@H]13	C20H25NO2	unknown
+CC[C@H]1C[C@@H]2C[C@H]3c4oc5ccc(O)cc5c4CCN(C2)[C@@H]13	C19H23NO2	unknown
+CC[C@@H]1C[C@@H]2C[C@H]3c4oc5ccc(O)cc5c4CCN(C2)[C@@H]13	C19H23NO2	unknown
+CC[C@H]1C[C@@H]2C[C@H]3c4sc5ccc(O)cc5c4CCN(C2)[C@@H]13	C19H23NOS	unknown
+CC[C@H]1C[C@@H]2C[C@H]3c4nc5ccc(O)cc5n4CCN(C2)[C@@H]13	C18H23N3O	unknown
+CCC[C@H]1C[C@@H]2C[C@H]3c4oc5ccc(OC)cc5c4CCN(C2)[C@@H]13	C21H27NO2	unknown
+CCC[C@@H]1C[C@@H]2C[C@H]3c4oc5ccc(OC)cc5c4CCN(C2)[C@@H]13	C21H27NO2	unknown
+COc1ccc2oc3c(c2c1)CCN1C[C@@H]2CC[C@H]1[C@H]3C2	C18H21NO2	unknown
+CC[C@H]1C[C@@H]2C[C@H]3c4oc5cc(OC)ccc5c4CCN(C2)[C@@H]13	C20H25NO2	unknown
+CC[C@H]1C[C@@H]2C[C@H]3c4oc5cccc(OC)c5c4CCN(C2)[C@@H]13	C20H25NO2	unknown
+CC[C@H]1C[C@@H]2C[C@H]3c4oc5c(OC)cccc5c4CCN(C2)[C@@H]13	C20H25NO2	unknown
+CC[C@H]1C[C@@H]2C[C@H]3c4oc5cc(C)c(OC)cc5c4CCN(C2)[C@@H]13	C21H27NO2	unknown
+CC[C@H]1C[C@@H]2C[C@H]3c4oc5cc(F)c(OC)cc5c4CCN(C2)[C@@H]13	C20H24FNO2	unknown
+CC[C@H]1C[C@@H]2C[C@H]3c4sc5ccc(OC)cc5c4CCN(C2)[C@@H]13	C20H25NOS	unknown
+CC[C@H]1C[C@@H]2C[C@H]3c4nc5ccc(OC)cc5n4CCN(C2)[C@@H]13	C19H25N3O	unknown
+CCC[C@H]1C[C@@H]2C[C@H]3c4oc5ccc(O)cc5c4CCN(C2)[C@@H]13	C20H25NO2	unknown
+CCC[C@@H]1C[C@@H]2C[C@H]3c4oc5ccc(O)cc5c4CCN(C2)[C@@H]13	C20H25NO2	unknown
+CC[C@H]1C[C@@H]2C[C@H]3c4oc5cc(O)ccc5c4CCN(C2)[C@@H]13	C19H23NO2	unknown
+CC[C@H]1C[C@@H]2C[C@H]3c4oc5c(O)cccc5c4CCN(C2)[C@@H]13	C19H23NO2	unknown
+CC[C@H]1C[C@@H]2C[C@H]3c4oc5cc(C)c(O)cc5c4CCN(C2)[C@@H]13	C20H25NO2	unknown
+CC[C@H]1C[C@@H]2C[C@H]3c4oc5cc(F)c(O)cc5c4CCN(C2)[C@@H]13	C19H22FNO2	unknown
+CC[C@H]1C[C@H]2CN3CCc4c([nH]c5ccccc45)[C@](C(=O)OC)(C2)[C@H]13	C21H26N2O2	unknown
+COC(=O)[C@@]12C[C@H]3C[C@H](CCO)[C@@H]1N(CCc1c2[nH]c2ccccc12)C3	C21H26N2O3	unknown
+COC(=O)[C@@]12C[C@H]3C[C@H](CCN(C)C)[C@@H]1N(CCc1c2[nH]c2ccccc12)C3	C23H31N3O2	unknown
+COCCOC(=O)[C@@]12C[C@H]3C[C@H](CCOC)[C@@H]1N(CCc1c2[nH]c2ccccc12)C3	C24H32N2O4	unknown
+COCC[C@H]1C[C@H]2CN3CCc4c([nH]c5ccccc45)[C@](C(=O)OCCN(C)C)(C2)[C@H]13	C25H35N3O3	unknown
+COCCNC(=O)[C@@]12C[C@H]3C[C@H](CCOC)[C@@H]1N(CCc1c2[nH]c2ccccc12)C3	C24H33N3O3	unknown
+CC[C@@H]1C[C@@H]2C[C@H]3c4[nH]c5ccc(O)cc5c4CCN(C2)[C@@H]13	C19H24N2O	unknown
+CC[C@H]1C[C@@H]2C[C@H]3c4oc5ccc(F)cc5c4CCN(C2)[C@@H]13	C19H22FNO	unknown
+CC[C@H]1C[C@@H]2C[C@H]3c4[nH]c5ccc(OCc6ccccc6)cc5c4CCN(C2)[C@@H]13	C26H30N2O	unknown
+CC[C@H]1C[C@@H]2C[C@H]3c4oc5ccc(O)cc5c4C[C@H](C)N(C2)[C@@H]13	C20H25NO2	unknown
+CC[C@@H]1C[C@@H]2C[C@H]3c4oc5ccc(OC)cc5c4CCN(C2)[C@@H]13	C20H25NO2	unknown
+COc1ccc2oc3c(c2c1)CCN1C[C@@H]2C[C@H](Cc4ccccc4)[C@H]1[C@H]3C2	C25H27NO2	unknown
+CC[C@H]1C[C@@H]2C[C@H]3c4oc5cccc(O)c5c4CCN(C2)[C@@H]13	C19H23NO2	unknown
+CNCC[C@H]1C[C@H]2CN3CCc4c([nH]c5ccccc45)[C@](C(=O)OC)(C2)[C@H]13	C22H29N3O2	unknown
+COCC[C@H]1C[C@H]2CN3CCc4c([nH]c5ccccc45)[C@](C(=O)NCCN(C)C)(C2)[C@H]13	C25H36N4O2	unknown
+CC[C@H]1C[C@H]2CN3CCc4c([nH]c5ccc(OC)cc45)[C@](C(=O)OC)(C2)[C@H]13	C22H28N2O3	unknown
+CCOc1cc(CC(C)N)c(OCC)cc1Br	C13H20BrNO2	unknown
+CCOc1nc(Cl)nc(NC2CCCC2)n1	C10H15ClN4O	cannabinoid
+CCOc1nc(NC2CCCC2)nc(N2CCNCC2)n1	C14H24N6O	cannabinoid
+CCOc1nc(NC2CCCC2)nc(N2CCN(CCCCCCCCN)CC2)n1	C22H41N7O	cannabinoid
+CCOc1nc(NC2CCCC2)nc(N2CCN(CCOCCOCCN)CC2)n1	C20H37N7O3	cannabinoid
+CCOc1nc(NC23CC4CC(CC(C4)C2)C3)nc(N2CCNCC2)n1	C19H30N6O	cannabinoid
+CCOc1nc(NC23CC4CC(CC(C4)C2)C3)nc(N2CCN(CCCCCCCCNC(=O)OC(C)(C)C)CC2)n1	C32H55N7O3	cannabinoid
+CCOc1nc(NC23CC4CC(CC(C4)C2)C3)nc(N2CCN(CCOCCOCCNC(=O)OC(C)(C)C)CC2)n1	C30H51N7O5	cannabinoid
+CCOc1nc(NC23CC4CC(CC(C4)C2)C3)nc(N2CCN(CCN)CC2)n1	C21H35N7O	cannabinoid
+CCOc1nc(NC23CC4CC(CC(C4)C2)C3)nc(N2CCN(CCCCCCCCN)CC2)n1	C27H47N7O	cannabinoid
+CCOc1nc(NC23CC4CC(CC(C4)C2)C3)nc(N2CCN(CCOCCOCCN)CC2)n1	C25H43N7O3	cannabinoid
+CCOc1nc(NC23CC4CC(CC(C4)C2)C3)nc(N2CCN(CCOCCOCCNC(C)=O)CC2)n1	C27H45N7O4	cannabinoid
+CCOc1nc(NC23CC4CC(CC(C4)C2)C3)nc(N2CCN(C)CC2)n1	C20H32N6O	cannabinoid
+CCOc1nc(NC23CC4CC(CC(C4)C2)C3)nc(N2CCN(CCF)CC2)n1	C21H33FN6O	cannabinoid
+CC(Cc1ccccc1)N(C)O	C10H15NO	unknown
+O=C(O)c1ccccc1	C7H6O2	unknown
+O=C(c1ccccc1)C1(N2CCCCC2)CCCCC1	C18H25NO	arylcycloalkylamine
+Oc1ccc2[nH]ccc2c1	C8H7NO	unknown
+Oc1ccc2cc[nH]c2c1	C8H7NO	unknown
+COC(=O)C(c1ccc2ccccc2c1)C1CCCCN1C(=O)C(F)(F)F	C20H20F3NO3	unknown
+CCOC(=O)C(c1ccc2ccccc2c1)C1CCCCN1C(=O)C(F)(F)F	C21H22F3NO3	unknown
+COC(=O)C(c1ccc(Cl)c(Cl)c1)C1CCCCN1C(=O)C(F)(F)F	C16H16Cl2F3NO3	unknown
+CC(N)CC#Cc1ccccc1	C11H13N	unknown
+CC(N)C/C=C/c1ccccc1	C11H15N	unknown
+CC(N)C/C=C\c1ccccc1	C11H15N	unknown
+CC(N)/C=C/c1ccccc1	C10H13N	unknown
+CC(N)/C=C\c1ccccc1	C10H13N	unknown
+CCCCC(NCC)C(=O)c1ccc(C)cc1	C15H23NO	beta-ketone
+CC(N)Cc1cccc2c1CCO2	C11H15NO	unknown
+O=C(CN1CCCC1)c1ccccc1	C12H15NO	beta-ketone
+CC(C)C(C(=O)c1ccccc1)N1CCCC1	C15H21NO	beta-ketone
+CCCC(C(=O)c1ccccc1)N1CCCCC1	C16H23NO	beta-ketone
+O=C1c2ccccc2CCC1N1CCCC1	C14H17NO	unknown
+CCCCCCC(C)(C)c1cc(O)c2c(c1)OC(C)(C)[C@H](CCO)[C@H]2CC(=O)O	C24H38O5	cannabinoid
+CCCCCCC(C)(C)c1cc(O)c2c(c1)OC(C)(C)[C@H](CCC(=O)O)[C@H]2CO	C24H38O5	cannabinoid
+CCCCCCC(C)(C)c1cc(O)c2c(c1)OC(C)(C)[C@@H]1CCOC(=O)C[C@@H]21	C24H36O4	cannabinoid
+CCCC(Cc1ccc2c(c1)OCO2)N1CCCC1	C16H23NO2	unknown
+CCCC(N)C(=O)c1ccc2c(c1)OCO2	C12H15NO3	beta-ketone
+CCCCC(=O)c1ccc2c(c1)OCO2	C12H14O3	unknown
+CC1(C)Oc2cc(C34CC5CC(CC(C5)C3)C4)cc(O)c2[C@@H]2CC(=O)CC[C@H]21	C25H32O3	cannabinoid
+CC1(C)Oc2cc(C34CC5CC(CC(C5)C3)C4)cc(O)c2[C@@H]2CC(C=O)CC[C@H]21	C26H34O3	cannabinoid
+CC1(C)Oc2cc(C34CC5CC(CC(C5)C3)C4)cc(O)c2[C@@H]2C[C@H](CI)CC[C@H]21	C26H35IO2	cannabinoid
+CC1(C)Oc2cc(C34CC5CC(CC(C5)C3)C4)cc(O)c2[C@@H]2CC(CCO)CC[C@H]21	C27H38O3	cannabinoid
+CC1(C)Oc2cc(C34CC5CC(CC(C5)C3)C4)cc(O)c2[C@@H]2CC(CC=O)CC[C@H]21	C27H36O3	cannabinoid
+CC(C)(C)C(=O)OCC1=CC[C@@H]2[C@@H](C1)c1c(O)cc(C34CC5CC(CC(C5)C3)C4)cc1OC2(C)C	C31H42O4	cannabinoid
+CC1(C)Oc2cc(C34CC5CC(CC(C5)C3)C4)cc(O)c2[C@@H]2CC(CO)=CC[C@H]21	C26H34O3	cannabinoid
+C=CCc1ccccc1OC(C)C1=NCCN1	C14H18N2O	unknown
+CC(Oc1ccccc1CC1CC1)C1=NCCN1	C15H20N2O	unknown
+CC(Oc1c(Cl)cccc1Cl)C1=NCCN1	C11H12Cl2N2O	unknown
+Cn1cc(C(=O)c2cccc3ccccc23)c2ccccc21	C20H15NO	cannabinoid
+c1ccc2c(c1)CC1NCC2c2ccccc21	C16H15N	arylcycloalkylamine
+CCC1CCCCC1(c1ccccc1)N1CCCCC1	C19H29N	arylcycloalkylamine
+CC1CCCCN1C1(c2ccccc2)CCCCC1	C18H27N	arylcycloalkylamine
+CCNC12CCCCC1Oc1ccccc12	C14H19NO	arylcycloalkylamine
+CCNC12CCCCC1Sc1ccccc12	C14H19NS	arylcycloalkylamine
+CCNC12CCCCC1Cc1ccccc12	C15H21N	arylcycloalkylamine
+CCNC12CCCCC1COc1ccccc12	C15H21NO	arylcycloalkylamine
+CCNC12CCCCC1CSc1ccccc12	C15H21NS	arylcycloalkylamine
+COc1ccc2c(c1)[C@]13CCCC[C@@H]1[C@H](C2)NCC3	C17H23NO	unknown
+NC(Cc1ccccc1)c1ccccc1	C14H15N	unknown
+CC(N)(Cc1ccccc1)c1ccccc1	C15H17N	unknown
+NC(c1ccccc1)C(N)c1ccccc1	C14H16N2	unknown
+NC(c1ccccc1)C(O)c1ccccc1	C14H15NO	unknown
+NC(CC1CCCCC1)C1CCCCC1	C14H27N	unknown
+COC(=O)C(N)c1ccccc1	C9H11NO2	unknown
+COC(=O)C(N)Cc1ccccc1	C10H13NO2	unknown
+NC(c1ccccc1)c1ccccc1	C13H13N	unknown
+CCN(CC)C(=O)N[C@H]1C=C2c3cccc4c3c(cn4C)C[C@H]2N(C)C1	C21H28N4O	unknown
+C=CCn1cc2c3c(cccc31)C1=C[C@H](NC(=O)N(CC)CC)CN(C)[C@@H]1C2	C23H30N4O	unknown
+CN(C)C(=O)N[C@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C18H22N4O	unknown
+CC(C)CN(CC(C)C)C(=O)N[C@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C24H34N4O	unknown
+CN1C[C@@H](NC(=O)N2CCCC2)C=C2c3cccc4[nH]cc(c34)C[C@H]21	C20H24N4O	unknown
+CN1C[C@@H](NC(=O)N2CCCCC2)C=C2c3cccc4[nH]cc(c34)C[C@H]21	C21H26N4O	unknown
+CCN(CC)C(=O)N[C@H]1C[C@@H]2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C20H28N4O	unknown
+CCN(CC)C(=O)N[C@H]1C[C@@H]2c3cccc4c3c(cn4C)C[C@H]2N(C)C1	C21H30N4O	unknown
+C=CCn1cc2c3c(cccc31)[C@H]1C[C@H](NC(=O)N(CC)CC)CN(C)[C@@H]1C2	C23H32N4O	unknown
+C=CCN1C[C@@H](NC(=O)N(CC)CC)C[C@@H]2c3cccc4c3c(cn4CC=C)C[C@H]21	C25H34N4O	unknown
+C=CCn1cc2c3c(cccc31)[C@H]1C[C@H](NC(=O)N(CC)CC)CN(CC)[C@@H]1C2	C24H34N4O	unknown
+CN(C)C(=O)N[C@H]1C[C@@H]2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C18H24N4O	unknown
+CC(C)CN(CC(C)C)C(=O)N[C@H]1C[C@@H]2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C24H36N4O	unknown
+CN1C[C@@H](NC(=O)N2CCCC2)C[C@@H]2c3cccc4[nH]cc(c34)C[C@H]21	C20H26N4O	unknown
+C=CCn1cc2c3c(cccc31)C1=C[C@@H](C(=O)N[C@]3(C)O[C@@]4(O)[C@@H]5CCCN5C(=O)[C@H](Cc5ccccc5)N4C3=O)CN(C)[C@@H]1C2	C36H39N5O5	unknown
+CN1C[C@H](C(=O)N[C@]2(C)O[C@@]3(O)[C@@H]4CCCN4C[C@H](Cc4ccccc4)N3C2=O)C[C@@H]2c3cccc4[nH]cc(c34)C[C@H]21	C33H39N5O4	unknown
+C=CCn1cc2c3c(cccc31)[C@H]1C[C@@H](C(=O)N[C@]3(C)O[C@@]4(O)[C@@H]5CCCN5C(=O)[C@H](Cc5ccccc5)N4C3=O)CN(C)[C@@H]1C2	C36H41N5O5	unknown
+CC(C)[C@@]1(NC(=O)[C@@H]2C=C3c4cccc5[nH]cc(c45)C[C@H]3N(C)C2)O[C@@]2(O)[C@@H]3CCCN3C(=O)[C@H](Cc3ccccc3)N2C1=O	C35H39N5O5	unknown
+CC(C)[C@@]1(NC(=O)[C@@H]2C=C3c4cccc5[nH]cc(c45)C[C@H]3N(C)C2)O[C@@]2(O)[C@@H]3CCCN3C[C@H](Cc3ccccc3)N2C1=O	C35H41N5O4	unknown
+CC(C)C[C@H]1C(=O)N2CCC[C@H]2[C@]2(O)O[C@](NC(=O)[C@@H]3C=C4c5cccc6[nH]cc(c56)C[C@H]4N(C)C3)(C(C)C)C(=O)N12	C32H41N5O5	unknown
+CC(C)C[C@H]1CN2CCC[C@H]2[C@]2(O)O[C@](NC(=O)[C@@H]3C=C4c5cccc6[nH]cc(c56)C[C@H]4N(C)C3)(C(C)C)C(=O)N12	C32H43N5O4	unknown
+CC(C)CNC(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C20H25N3O	unknown
+CN1C[C@H](C(=O)NC(C)(C)C)C=C2c3cccc4[nH]cc(c34)C[C@H]21	C20H25N3O	unknown
+COc1ccccc1C(C)NCCn1c(=O)[nH]c2ccccc2c1=O	C19H21N3O3	unknown
+COc1cc(CCNCc2ccccc2O)cc(OC)c1OC	C18H23NO4	unknown
+CCOc1c(OC)cc(CCNCc2ccccc2O)cc1OC	C19H25NO4	unknown
+C1=C(c2c[nH]c3ccccc23)CCNC1	C13H14N2	unknown
+Fc1ccc2[nH]cc(C3=CCNCC3)c2c1	C13H13FN2	unknown
+CC(CN1CCC(C(=O)c2ccc(F)cc2)CC1)n1c(=S)[nH]c2ccccc2c1=O	C23H24FN3O2S	unknown
+CC(CCN1CC=C(c2ccc(F)cc2)CC1)n1c(=O)[nH]c2ccccc2c1=O	C23H24FN3O2	unknown
+Cc1cc(C(=O)C(C)NC(C)(C)C)ccc1Br	C14H20BrNO	beta-ketone
+CCCCCCC(NC(C)(C)C)C(=O)c1cccc(Cl)c1	C18H28ClNO	beta-ketone
+CC(C)CC(NC(C)(C)C)C(=O)c1cccc(Cl)c1	C16H24ClNO	beta-ketone
+CC(C)(C)NC(CCC1CCCCC1)C(=O)c1cccc(Cl)c1	C20H30ClNO	beta-ketone
+CCCNC(C)C(=O)c1cccc(Cl)c1	C12H16ClNO	beta-ketone
+CC(C)NC(C)C(=O)c1cccc(Cl)c1	C12H16ClNO	beta-ketone
+CC(NC1CC1)C(=O)c1cccc(Cl)c1	C12H14ClNO	beta-ketone
+CC(NC1CCC1)C(=O)c1cccc(Cl)c1	C13H16ClNO	beta-ketone
+CC(NC1CCCC1)C(=O)c1cccc(Cl)c1	C14H18ClNO	beta-ketone
+CCC(NC(C)(C)C)C(=O)c1ccc(Cl)c(Cl)c1	C14H19Cl2NO	beta-ketone
+CCCC(NC(C)(C)C)C(=O)c1ccc(Cl)c(Cl)c1	C15H21Cl2NO	beta-ketone
+CC(C(=O)c1cccc(Cl)c1)N(C)C(C)(C)C	C14H20ClNO	beta-ketone
+CCN(CC)C(C)C(=O)c1cccc(Cl)c1	C13H18ClNO	beta-ketone
+CC(C(=O)c1cccc(Cl)c1)N1CCCCC1	C14H18ClNO	beta-ketone
+CC(NC(C)(C)C)C(=O)c1cccs1	C11H17NOS	unknown
+CC(CNC(C)(C)C)C(=O)c1cccc(Cl)c1	C14H20ClNO	unknown
+CC1C(=O)c2cc(Cl)ccc2CN1C(C)(C)C	C14H18ClNO	unknown
+CC(C)(C)NC1CCc2ccc(Cl)cc2C1=O	C14H18ClNO	unknown
+CC(NC(C)(C)C)C(O)c1ccccc1	C13H21NO	unknown
+COc1cccc(C(=O)C(C)NC(C)(C)C)c1	C14H21NO2	beta-ketone
+CC(NC(C)(C)C)C(=O)c1cccc([N+](=O)[O-])c1	C13H18N2O3	beta-ketone
+CC(NC1CCCC1)C(=O)c1cccc(F)c1	C14H18FNO	beta-ketone
+CC(NC1CCCC1)C(=O)c1cccc(Br)c1	C14H18BrNO	beta-ketone
+Cc1cccc(C(=O)C(C)NC2CCCC2)c1	C15H21NO	beta-ketone
+COc1cccc(C(=O)C(C)NC2CCCC2)c1	C15H21NO2	beta-ketone
+CC(NC1CCCC1)C(=O)c1cccc([N+](=O)[O-])c1	C14H18N2O3	beta-ketone
+CC(C(=O)c1cccc(F)c1)N1CCCCC1	C14H18FNO	beta-ketone
+CC(C(=O)c1cccc(Br)c1)N1CCCCC1	C14H18BrNO	beta-ketone
+Cc1cccc(C(=O)C(C)N2CCCCC2)c1	C15H21NO	beta-ketone
+COc1cccc(C(=O)C(C)N2CCCCC2)c1	C15H21NO2	beta-ketone
+CC(C(=O)c1cccc([N+](=O)[O-])c1)N1CCCCC1	C14H18N2O3	beta-ketone
+O=C(C(=O)N1CCCC1)c1c[nH]c2ccccc12	C14H14N2O2	tryptamine
+OC(Cc1c[nH]c2ccccc12)N1CCCC1	C14H18N2O	tryptamine
+CCN(CC)C(=O)C(=O)c1c[nH]c2ccccc12	C14H16N2O2	tryptamine
+CCN(CC)C(O)Cc1c[nH]c2ccccc12	C14H20N2O	tryptamine
+C[C@@H]1[C@H](C)N1C(=O)c1ccccc1	C11H13NO	unknown
+CC(Cl)C(C)NC(=O)c1ccccc1	C11H14ClNO	unknown
+COc1ccc(OC)c(C=C(C)C)c1	C12H16O2	unknown
+COc1ccc(OC)c(CC(C)C)c1	C12H18O2	unknown
+COc1cc(CC(C)C)c(OC)cc1C=O	C13H18O3	unknown
+COc1cc(CC(C)C)c(OC)cc1/C=C(\C)[N+](=O)[O-]	C15H21NO4	unknown
+CCC(C)c1cc(OC)ccc1OC	C12H18O2	unknown
+CCC(=O)c1cc(OC)ccc1OC	C11H14O3	unknown
+COc1cc(C(C)=O)c(OC)cc1C(C)=O	C12H14O4	unknown
+C/C=C(\C)c1cc(OC)ccc1OC	C12H16O2	unknown
+C/C=C(/C)c1cc(OC)ccc1OC	C12H16O2	unknown
+CCC(C)c1cc(OC)c(C(C)=O)cc1OC	C14H20O3	unknown
+CCC(C)c1cc(OC)c(/C=C(\C)[N+](=O)[O-])cc1OC	C15H21NO4	unknown
+CC(C)(C)OC(=O)c1cc2c(cn1)[nH]c1ccccc12	C16H16N2O2	unknown
+c1ccc2c(c1)[nH]c1c2ncc2[nH]c3ccccc3c21	C17H11N3	unknown
+CCOC(=O)c1ncn2c1CN(C)C(=O)c1ccccc1-2	C15H15N3O3	aryldiazepine
+CCOC(=O)c1ncn2c1CN(C)C(=O)c1cc(Cl)ccc1-2	C15H14ClN3O3	aryldiazepine
+CCOC(=O)c1ncn2c1CN(C)C(=O)c1cc(Br)ccc1-2	C15H14BrN3O3	aryldiazepine
+CCOC(=O)c1ncn2c1CN(C)C(=O)c1cc(C#N)ccc1-2	C16H14N4O3	aryldiazepine
+C=Cc1ccc2c(c1)C(=O)N(C)Cc1c(C(=O)OCC)ncn1-2	C17H17N3O3	aryldiazepine
+CCOC(=O)c1ncn2c1CN(C)C(=O)c1cc(CC)ccc1-2	C17H19N3O3	aryldiazepine
+CCOC(=O)c1ncn2c1CN(C)C(=O)c1cc(OCC)ccc1-2	C17H19N3O4	aryldiazepine
+C=C=Cc1ccc2c(c1)C(=O)N(C)Cc1c(C(=O)OCC)ncn1-2	C18H17N3O3	aryldiazepine
+C#Cc1ccc2c(c1)C(=O)N(C)Cc1c(C(=O)OCC)ncn1-2	C17H15N3O3	aryldiazepine
+CC#Cc1ccc2c(c1)C(=O)N(C)Cc1c(C(=O)OCC)ncn1-2	C18H17N3O3	aryldiazepine
+CCOC(=O)c1ncn2c1CN(C)C(=O)c1cc(C#C[Si](C)(C)C)ccc1-2	C20H23N3O3Si	aryldiazepine
+CCOC(=O)c1ncn2c1CN(C)C(=O)c1cc(C#CC[Si](C)(C)C)ccc1-2	C21H25N3O3Si	aryldiazepine
+CN1Cc2c(C(=O)OC(C)(C)C)ncn2-c2ccc(C#C[Si](C)(C)C)cc2C1=O	C22H27N3O3Si	aryldiazepine
+C#Cc1ccc2c(c1)C(=O)N1CCCC1c1c(C(=O)OCC)ncn1-2	C19H17N3O3	aryldiazepine
+CCOC(=O)c1ncn2c1C1CCN1C(=O)c1cc(Br)ccc1-2	C16H14BrN3O3	aryldiazepine
+C#Cc1ccc2c(c1)C(=O)N1CCCC1c1c(-c3nc(C)no3)ncn1-2	C19H15N5O2	unknown
+C#Cc1ccc2c(c1)C(=O)N1CCCC1c1c(-c3nc(CC)no3)ncn1-2	C20H17N5O2	unknown
+C#Cc1ccc2c(c1)C(=O)N1CCCC1c1c(-c3nc(C(C)C)no3)ncn1-2	C21H19N5O2	unknown
+C#Cc1ccc2c(c1)C(=O)N1CCCC1c1c(-c3nc(-c4ccccc4)no3)ncn1-2	C24H17N5O2	unknown
+C#Cc1ccc2c(c1)C(=O)N1CCC1c1c(-c3nc(C)no3)ncn1-2	C18H13N5O2	unknown
+C#Cc1ccc2c(c1)C(=O)N1CCC1c1c(-c3nc(CC)no3)ncn1-2	C19H15N5O2	unknown
+C#Cc1ccc2c(c1)C(=O)N1CCC1c1c(-c3nc(C(C)C)no3)ncn1-2	C20H17N5O2	aryldiazepine
+C#Cc1ccc2c(c1)C(=O)N1CCC1c1c(-c3nc(-c4ccccc4)no3)ncn1-2	C23H15N5O2	aryldiazepine
+CCOC(=O)c1ncn2c1C1CCCN1C(=O)c1ccccc1-2	C17H17N3O3	aryldiazepine
+CCOc1cc2c(cn1)[nH]c1ccccc12	C13H12N2O	unknown
+C#Cc1ccc(-n2[nH]c3c(cnc4ccccc43)c2=O)cc1	C18H11N3O	unknown
+CN1C(=O)CN=C(c2ccco2)c2cc(Cl)ccc21	C14H11ClN2O2	aryldiazepine
+CN1C(=O)CN=C(c2ccsc2)c2cc(Cl)ccc21	C14H11ClN2OS	aryldiazepine
+O=C1CN=C(c2cccs2)c2cc(F)ccc2N1	C13H9FN2OS	aryldiazepine
+CN1C(=O)CN=C(c2cccs2)c2cc(F)ccc21	C14H11FN2OS	aryldiazepine
+[N-]=[N+]=Nc1ccc2c(c1)C(c1ccccc1N=[N+]=[N-])=NCC(=O)N2	C15H10N8O	aryldiazepine
+CN1C(=O)CN=C(c2ccccc2[N+](=O)[O-])c2cc([N+](=O)[O-])ccc21	C16H12N4O5	aryldiazepine
+CN1C(=O)CN=C(c2ccccc2)c2cc(C#C[Si](C)(C)C)ccc21	C21H22N2OSi	aryldiazepine
+CN1C(=O)CN=C(c2ccccc2)c2cc(C#N)ccc21	C17H13N3O	aryldiazepine
+O=C1CN=C(c2ccccc2)c2ccccc2N1	C15H12N2O	aryldiazepine
+CN1C(=O)CN=C(c2ccccc2)c2ccccc21	C16H14N2O	aryldiazepine
+CCn1c(=O)n([C@@H]2CCN(CC3CCCCCCC3)C[C@H]2CO)c2ccccc21	C24H37N3O2	unknown
+O=c1[nH]c2ccccc2n1C1CCN(Cc2ccccc2)CC1	C19H21N3O	unknown
+CC(c1ccccc1Cl)N1CCC(n2c(=O)[nH]c3ccccc32)CC1	C20H22ClN3O	unknown
+O=c1[nH]c2ccccc2n1C1CCN(CC2CCCCCCC2)CC1	C21H31N3O	unknown
+CCn1c(=O)n(C2CCN(CC3CCCCCCC3)CC2)c2ccccc21	C23H35N3O	unknown
+CCn1c(=O)n([C@H]2CCN(CC3CCCCCCC3)C[C@@H]2CO)c2ccccc21	C24H37N3O2	unknown
+CO[C@H]1CC[C@H](OC(=O)[C@@H]2C[C@@H]3c4cccc5c4c(cn5C(C)C)C[C@H]3N(C)C2)CC1	C26H36N2O3	unknown
+CC(O)C(C)OC(=O)[C@@H]1C[C@@H]2c3cccc4c3c(cn4C(C)C)C[C@H]2N(C)C1	C23H32N2O3	unknown
+CN1C[C@H](CO)C[C@@H]2c3cccc4[nH]cc(c34)C[C@H]21	C16H20N2O	unknown
+CCC(C)C(=O)OC[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C21H26N2O2	unknown
+CCC(CC)C(=O)OC[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C22H28N2O2	unknown
+CCC(C)C(=O)OC[C@@H]1C[C@@H]2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C21H28N2O2	unknown
+CCC(CC)C(=O)OC[C@@H]1C[C@@H]2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C22H30N2O2	unknown
+CCC(C)C(=O)OC[C@@H]1C=C2c3cccc4c3c(cn4C(C)C)C[C@H]2N(C)C1	C24H32N2O2	unknown
+CCC(CC)C(=O)OC[C@@H]1C=C2c3cccc4c3c(cn4C(C)C)C[C@H]2N(C)C1	C25H34N2O2	unknown
+CCC(C)C(=O)OC[C@@H]1C[C@@H]2c3cccc4c3c(cn4C(C)C)C[C@H]2N(C)C1	C24H34N2O2	unknown
+CCC(CC)C(=O)OC[C@@H]1C[C@@H]2c3cccc4c3c(cn4C(C)C)C[C@H]2N(C)C1	C25H36N2O2	unknown
+CC/C(=C\c1ccc2c(c1)OCO2)[N+](=O)[O-]	C11H11NO4	unknown
+CC/C(=C\c1cc(OC)ccc1OC)[N+](=O)[O-]	C12H15NO4	unknown
+CC(Br)Cc1ccc2c(c1)OCO2	C10H11BrO2	unknown
+BrCCCc1ccc2c(c1)OCO2	C10H11BrO2	unknown
+NCC12CC3CC(CC(C3)C1)C2	C11H19N	unknown
+NCCCC12CC3CC(CC(C3)C1)C2	C13H23N	unknown
+NCCCCC12CC3CC(CC(C3)C1)C2	C14H25N	unknown
+CC12CC3CC(C)(C1)CC(CCN)(C3)C2	C14H25N	unknown
+CCC12CC3CC(N)(C1)CC(CC)(C3)C2	C14H25N	unknown
+CNC12CC3CC(C)(CC(C)(C3)C1)C2	C13H23N	unknown
+CN(C)C12CC3CC(C)(CC(C)(C3)C1)C2	C14H25N	unknown
+CCNC12CC3CC(C)(CC(C)(C3)C1)C2	C14H25N	unknown
+NCCC12CC3CC(CC(C3)C1)C2	C12H21N	unknown
+CCC12CC3CC(CC(N)(C3)C1)C2	C12H21N	unknown
+CC(C)C12CC3CC(CC(N)(C3)C1)C2	C13H23N	unknown
+NC12CC3CC(C1)CC(c1ccccc1)(C3)C2	C16H21N	unknown
+CCC12CC3CC(N)(C1)CC(c1ccccc1)(C3)C2	C18H25N	unknown
+CN(C)C12CC3CC(CC(C3)C1)C2	C12H21N	unknown
+CNC12CC3CC(CC(C3)C1)C2	C11H19N	unknown
+COc1cc(CCN)c(O)cc1CCCO	C12H19NO3	unknown
+COc1cc(C(O)CN)c(OC)cc1CCCO	C13H21NO4	unknown
+CCCc1cc(OC)c(C(O)CN)cc1OC	C13H21NO3	unknown
+CCCc1cc(OC)c(C(O)CNC(C)=O)cc1OC	C15H23NO4	unknown
+COc1cc(CC(C)O)c(OC)cc1CCN	C13H21NO3	unknown
+COc1cc(CC(C)O)c(OC)cc1CCNC(C)=O	C15H23NO4	unknown
+COc1cc(CC(C)=O)c(OC)cc1CCN	C13H19NO3	unknown
+COc1cc(CCC(=O)O)c(OC)cc1CCN	C13H19NO4	unknown
+CCCc1cc(OC)c(CCNC(C)=O)cc1OC	C15H23NO3	unknown
+CCCc1cc(O)c(CCN)cc1OC	C12H19NO2	unknown
+CCCc1cc(O)c(CCNC(C)=O)cc1OC	C14H21NO3	unknown
+CCCc1cc(O)c(CCN)cc1O	C11H17NO2	unknown
+COc1cc(CCCO)c(OC)cc1CCO	C13H20O4	unknown
+COc1cc(CC(=O)O)c(OC)cc1CCCO	C13H18O5	unknown
+CCCc1cc(OC)c(CCO)cc1OC	C13H20O3	unknown
+CCCc1cc(O)c(CCO)cc1OC	C12H18O3	unknown
+CCCc1cc(O)c(CC(=O)O)cc1OC	C12H16O4	unknown
+O=C(c1ccc(F)cc1)C1CCN(CCCCCS)CC1	C17H24FNOS	unknown
+C[N+]12CC[S][Tc]1(=[O])([S]CCCCCN1CCC(C(=O)c3ccc(F)cc3)CC1)[S]CC2	C17H24FNOS.C5H13NS2.O.Tc	unknown
+C[N+]12CC[S][Re]1(=[O])([S]CCCCCN1CCC(C(=O)c3ccc(F)cc3)CC1)[S]CC2	C17H24FNOS.C5H13NS2.O.Re	unknown
+C=CCn1cc2c3c(cccc31)[C@H]1C[C@H](NC(=O)N(CC)CC)CN(CCC)[C@@H]1C2	C25H36N4O	unknown
+CN1c2ccccc2C(NCCCCC(=O)O)c2ccc(Cl)cc2S1(=O)=O	C19H21ClN2O4S	unknown
+CCCCCNC1c2ccccc2N(C)S(=O)(=O)c2cc(Cl)ccc21	C19H23ClN2O2S	unknown
+COCCCNC1c2ccccc2N(C)S(=O)(=O)c2cc(Cl)ccc21	C18H21ClN2O3S	unknown
+COCCCCCNC1c2ccccc2N(C)S(=O)(=O)c2cc(Cl)ccc21	C20H25ClN2O3S	unknown
+CCOC(=O)CCCCCCNC1c2ccccc2N(C)S(=O)(=O)c2cc(Cl)ccc21	C23H29ClN2O4S	unknown
+CN1c2ccccc2C(NCCCCCCC(=O)O)c2ccc(Br)cc2S1(=O)=O	C21H25BrN2O4S	unknown
+CN1c2ccccc2C(NCCCCCCC(=O)O)c2ccc(I)cc2S1(=O)=O	C21H25IN2O4S	unknown
+CN1c2ccccc2C(NCCCCOCC(=O)O)c2ccc(Cl)cc2S1(=O)=O	C20H23ClN2O5S	unknown
+CN1c2cc(Cl)ccc2C(NCCCCCCC(=O)O)c2ccc(Cl)cc2S1(=O)=O	C21H24Cl2N2O4S	unknown
+COCCCNC1c2ccccc2N(C)S(=O)(=O)c2cc(Br)ccc21	C18H21BrN2O3S	unknown
+COCCCNC1c2ccccc2N(C)S(=O)(=O)c2cc(I)ccc21	C18H21IN2O3S	unknown
+COCCCNC1c2ccccc2N(C)S(=O)(=O)c2cc(SC)ccc21	C19H24N2O3S2	unknown
+CCOC(=O)CCCCCCNC1c2ccccc2N(C)S(=O)(=O)c2cc(Br)ccc21	C23H29BrN2O4S	unknown
+CCOC(=O)CCCCCCNC1c2ccccc2N(C)S(=O)(=O)c2cc(I)ccc21	C23H29IN2O4S	unknown
+COCCCNC1c2ccccc2N(C)S(=O)(=O)c2cc(OC)ccc21	C19H24N2O4S	unknown
+COCCCNC1c2ccccc2N(C)S(=O)(=O)c2cc(Oc3ccccc3)ccc21	C24H26N2O4S	unknown
+CCCOC(=O)CCCCCCNC1c2ccccc2N(CCC)S(=O)(=O)c2cc(Br)ccc21	C26H35BrN2O4S	unknown
+COc1ccc2c(c1)c1c3n2CCNC3=NCC1	C14H15N3O	unknown
+c1ccc(CCCN2CCN(CCOC(c3ccccc3)c3ccccc3)CC2)cc1	C28H34N2O	unknown
+CCC(N)Cc1c[nH]c2cccc(OC(C)=O)c12	C14H18N2O2	tryptamine
+CCC(=O)c1ccc2[nH]cc(CCN(C)C)c2c1	C15H20N2O	tryptamine
+CCNC(C(=O)c1ccccc1)c1ccccc1	C16H17NO	beta-ketone
+CCCC1CN(C)CCC1c1ccc(Cl)cc1	C15H22ClN	unknown
+O=S(Cc1cncs1)C(c1ccccc1)c1ccccc1	C17H15NOS2	unknown
+CCCN[C@@H]1Cc2cccc3[nH]c(=O)n(c23)C1	C13H17N3O	unknown
+O=C(c1ccco1)N(c1ccccc1F)C1CCN(CCc2ccccc2)CC1	C24H25FN2O2	fentanyl
+CCCCCn1cc(C(=O)c2cccc3ccc(OC)cc23)c2ccccc21	C25H25NO2	cannabinoid
+CCCCCn1c2ccccc2c2c(O)c3c(cc21)OC(C)(C)[C@@H]1CCC(C)=C[C@@H]31	C27H33NO2	cannabinoid
+CCC(=O)N(c1ccccc1)C1CCCCC1N(C)C	C17H26N2O	unknown
+CN(C)C1CCCCC1N(C(=O)c1ccco1)c1ccccc1	C19H24N2O2	unknown
+Cc1ccc(-n2nccn2)c(C(=O)N2CCN(c3nc4cc(Cl)ccc4o3)CC[C@H]2C)c1	C23H23ClN6O2	unknown
+COc1cccc(N(C(=O)c2ccco2)C2CCN(CCc3ccccc3)CC2)c1	C25H28N2O3	fentanyl
+O=c1[nH]c2cc(Cl)ccc2o1	C7H4ClNO2	unknown
+CN(CCc1c[nH]c2ccccc12)C1CCC1	C15H20N2	tryptamine
+COc1ccc2[nH]cc(CCN(C)C3CCC3)c2c1	C16H22N2O	tryptamine
+c1ccc2c(CCN(C3CCC3)C3CCC3)c[nH]c2c1	C18H24N2	tryptamine
+COc1ccc2[nH]cc(CCN(C3CCC3)C3CCC3)c2c1	C19H26N2O	tryptamine
+COc1cc(CCN)cc(OC)c1OCC1CCC1	C15H23NO3	unknown
+CCC(=O)N(c1ccccc1)C1CCN(C(C)(C)Cc2ccccc2)CC1	C24H32N2O	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CCc2cccc(F)c2)CC1	C22H27FN2O	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(C(C)Cc2ccc3ccoc3c2)CC1	C25H30N2O2	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(C(C)Cc2ccc3c(c2)OCC3)CC1	C25H32N2O2	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CCc2c(OC)cccc2OC)CC1	C24H32N2O3	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CCc2ccc(OC)cc2OC)CC1	C24H32N2O3	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(C(C)Cc2cc(OC)ccc2OC)CC1	C25H34N2O3	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CCc2cc(OC)c(C)cc2OC)CC1	C25H34N2O3	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CCc2cc(OC)c(I)cc2OC)CC1	C24H31IN2O3	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CCc2cc(OC)c(Cl)cc2OC)CC1	C24H31ClN2O3	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CCc2cc(OC)c(C)c(C)c2OC)CC1	C26H36N2O3	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(C(C)Cc2cc(OC)c(C)cc2OC)CC1	C26H36N2O3	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CCc2cc(OC)c(CC)cc2OC)CC1	C26H36N2O3	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(C(C)Cc2c3c(c(Br)c4c2OCC4)OCC3)CC1	C27H33BrN2O3	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(C(C)Cc2cc(OC)c(Cl)cc2OC)CC1	C25H33ClN2O3	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CCc2cc(OC)c(SC)cc2OC)CC1	C25H34N2O3S	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CCc2c3c(c(Br)c4c2OCC4)OCC3)CC1	C26H31BrN2O3	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(C(C)Cc2cc(OC)c(OC)c(OC)c2)CC1	C26H36N2O4	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CCc2cc(OC)c(C(C)C)cc2OC)CC1	C27H38N2O3	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(C(C)Cc2cc(OC)c(CC)cc2OC)CC1	C27H38N2O3	fentanyl
+CCSc1cc(OC)c(CCN2CCC(N(C(=O)CC)c3ccccc3)CC2)cc1OC	C26H36N2O3S	fentanyl
+CCCSc1cc(OC)c(CCN2CCC(N(C(=O)CC)c3ccccc3)CC2)cc1OC	C27H38N2O3S	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CCc2cc(OC)c(SC(C)C)cc2OC)CC1	C27H38N2O3S	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CCc2cc(OC)c(C(F)(F)F)cc2OC)CC1	C25H31F3N2O3	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(C(C)Cc2cc3ccccc3o2)CC1	C25H30N2O2	fentanyl
+CCC(C)N(CCc1c[nH]c2ccccc12)C(C)C	C17H26N2	prophetic,tryptamine
+CCCCC(C(=O)c1ccc(OC)c(OCC)c1)N(CC)CC	C19H31NO3	beta-ketone
+CC(C)N(CCc1c[nH]c2ccc(F)cc12)C(C)C	C16H23FN2	prophetic,tryptamine
+C[C@H]1CC[C@H](C)N1CCc1c[nH]c2ccccc12	C16H22N2	tryptamine
+C[C@@H]1CC[C@@H](C)N1CCc1c[nH]c2ccccc12	C16H22N2	tryptamine
+C=CCN(CC)CCc1c[nH]c2ccc(OC)cc12	C16H22N2O	prophetic,tryptamine
+C=CCN(CCC)CCc1c[nH]c2ccc(OC)cc12	C17H24N2O	prophetic,tryptamine
+C=CCN(CCc1c[nH]c2ccc(OC)cc12)C(C)C	C17H24N2O	prophetic,tryptamine
+CC(C)N(CCc1c[nH]c2ccccc12)C1CC1	C16H22N2	prophetic,tryptamine
+CCCCC(C(=O)c1cc(OC)c2c(c1)OCO2)N(CC)CC	C18H27NO4	beta-ketone
+COc1cc(CCN)cc(OC)c1-c1ccccc1	C16H19NO2	unknown
+CC(=O)Oc1cccc(C2(C(C)=O)CCN(C)CC2)c1	C16H21NO3	unknown
+Fc1cccc(N2CCNCC2)c1Cl	C10H12ClFN2	unknown
+CCCc1cc(O)c(C/C=C(/C)CCC=C(C)C)c(O)c1	C19H28O2	cannabinoid
+COCCN(C)Cc1csc(-c2cn(CCCCCF)c3ccccc23)n1	C21H28FN3OS	cannabinoid
+CCCCn1nc(C(=O)N[C@H](C(=O)OC)C(C)(C)C)c2ccccc21	C19H27N3O3	cannabinoid
+CCCC(C(=O)c1cc2c(cc1OC)OCO2)N(CC)CC	C17H25NO4	beta-ketone
+CCNC1(c2cccc(OCC)c2)CCCCC1=O	C16H23NO2	arylcycloalkylamine
+COc1ccc2oc3ccccc3c2c1C=O	C14H10O3	unknown
+COc1cc2c(cc1C=O)oc1ccccc12	C14H10O3	unknown
+COc1ccc2oc3ccccc3c2c1	C13H10O2	unknown
+COc1ccc2oc3ccccc3c2c1CCN	C15H15NO2	unknown
+COc1cc2c(cc1CCN)oc1ccccc12	C15H15NO2	unknown
+COc1cc(CCNCc2c(OC)ccc3oc4ccccc4c23)c(OC)cc1Br	C24H24BrNO4	unknown
+COc1cc(CCNCc2cc3oc4ccccc4c3cc2OC)c(OC)cc1Br	C24H24BrNO4	unknown
+CN1CC[C@]23c4c5ccc(O)c4O[C@H]2[C@@H](OC(=O)C(C)(C)C)C=C[C@H]3[C@H]1C5	C22H27NO4	unknown
+CN1CC[C@]23c4c5ccc(OC(=O)C(C)(C)C)c4O[C@H]2[C@@H](OC(=O)C(C)(C)C)C=C[C@H]3[C@H]1C5	C27H35NO5	unknown
+COc1cccc(C2(NC(C)C)CCCCC2=O)c1	C16H23NO2	arylcycloalkylamine
+CN(C)C1(CNS(=O)(=O)c2ccc(Cl)c(Cl)c2)CCCCC1	C15H22Cl2N2O2S	unknown
+CN(C)C1(CNC(=O)c2ccc(Br)cc2)CCCCC1	C16H23BrN2O	unknown
+CN(C)C1(CNC(=O)c2cccnc2Cl)CCCCC1	C15H22ClN3O	unknown
+CN(C)C1(CNC(=O)c2cccc3ccccc23)CCCCC1	C20H26N2O	unknown
+CN(C)C1(CNC(=O)c2cccnc2)CCCCC1	C15H23N3O	unknown
+CN(C)C1(CNC(=O)c2ccncc2)CCCCC1	C15H23N3O	unknown
+CN(C)C1(CNC(=O)C23CC4CC(CC(C4)C2)C3)CCCCC1	C20H34N2O	unknown
+CN(C)C1(CNC(=O)c2cccc(F)c2)CCCCC1	C16H23FN2O	unknown
+CN(C)C1(CNC(=O)c2ccc(Cl)s2)CCCCC1	C14H21ClN2OS	unknown
+CN(C)C1(CNC(=O)c2ccccc2)CCCCC1	C16H24N2O	unknown
+CN(C)C1(CNC(=O)c2cccc(Cl)c2)CCCCC1	C16H23ClN2O	unknown
+CN(C)C1(CNC(=O)c2ccc(Cl)c(Cl)c2)CCC2(CC1)OCCO2	C18H24Cl2N2O3	unknown
+CN(C)[C@@H]1CCCC[C@H]1N(C)C(=O)c1ccc(Cl)cc1	C16H23ClN2O	unknown
+CN(C)[C@@H]1CCCC[C@H]1N(C)C(=O)c1ccc(F)cc1	C16H23FN2O	unknown
+CN(C)[C@@H]1CCCC[C@H]1N(C)C(=O)c1ccc(C(F)(F)F)cc1	C17H23F3N2O	unknown
+COc1ccc(C(=O)N(C)[C@@H]2CCCC[C@H]2N(C)C)cc1	C17H26N2O2	unknown
+CN(C)[C@@H]1CCCC[C@H]1N(C)C(=O)c1ccc(F)c(F)c1	C16H22F2N2O	unknown
+CN(C)[C@@H]1CCCC[C@H]1N(C)S(=O)(=O)c1ccc(Cl)c(Cl)c1	C15H22Cl2N2O2S	unknown
+CN(C)[C@@H]1CCCC[C@H]1N(C)C(=O)c1cccnc1Cl	C15H22ClN3O	unknown
+CN(C)[C@@H]1CCCC[C@H]1N(C)C(=O)c1cccc2ccccc12	C20H26N2O	unknown
+CN(C)[C@@H]1CCCC[C@H]1N(C)C(=O)c1cccnc1	C15H23N3O	unknown
+CN(C)[C@@H]1CCCC[C@H]1N(C)C(=O)c1ccncc1	C15H23N3O	unknown
+CN(C)[C@@H]1CCCC[C@H]1N(C)C(=O)c1ccccc1	C16H24N2O	unknown
+CN(C)[C@@H]1CCCC[C@H]1N(C)C(=O)C12CC3CC(CC(C3)C1)C2	C20H34N2O	unknown
+CN(C)[C@@H]1CCCC[C@H]1N(C)C(=O)c1cccc(Cl)c1	C16H23ClN2O	unknown
+CN(C)[C@@H]1CCCC[C@H]1N(C)C(=O)c1cccc(F)c1	C16H23FN2O	unknown
+CN(C)[C@@H]1CCCC[C@H]1N(C)C(=O)c1ccc(Cl)s1	C14H21ClN2OS	unknown
+CN(C)[C@@H]1CCCC[C@H]1NC(=O)c1ccc(Cl)c(Cl)c1	C15H20Cl2N2O	unknown
+CN(C)[C@@H]1CCCC[C@H]1NC(=O)c1ccc(Cl)cc1	C15H21ClN2O	unknown
+CN(C)[C@@H]1CCCC[C@H]1NC(=O)c1ccc(F)cc1	C15H21FN2O	unknown
+CN(C)[C@@H]1CCCC[C@H]1NC(=O)c1ccc(C(F)(F)F)cc1	C16H21F3N2O	unknown
+COc1ccc(C(=O)N[C@@H]2CCCC[C@H]2N(C)C)cc1	C16H24N2O2	unknown
+CN(C)[C@@H]1CCCC[C@H]1NC(=O)c1ccc(F)c(F)c1	C15H20F2N2O	unknown
+CN(C)[C@@H]1CCCC[C@H]1NS(=O)(=O)c1ccc(Cl)c(Cl)c1	C14H20Cl2N2O2S	unknown
+CN(C)[C@@H]1CCCC[C@H]1NC(=O)c1ccc(Br)cc1	C15H21BrN2O	unknown
+CN(C)[C@@H]1CCCC[C@H]1NC(=O)c1cccnc1Cl	C14H20ClN3O	unknown
+COc1ccc2c3c1O[C@H]1[C@@H](OC(C)=O)CC[C@H]4[C@@H](C2)N(C)CC[C@@]341	C20H25NO4	unknown
+CN1CC[C@]23c4c5ccc(OCc6ccccc6)c4O[C@H]2[C@@H](O)C=C[C@H]3[C@H]1C5	C24H25NO3	unknown
+COc1ccc2c3c1O[C@H]1/C(=N/OCC(=O)O)CC[C@H]4[C@@H](C2)N(C)CC[C@]314	C20H24N2O5	unknown
+COc1ccc2c3c1O[C@H]1[C@@H](O)CC[C@H]4[C@@H](C2)N(C)CC[C@@]341	C18H23NO3	unknown
+CN1CC[C@]23c4c5ccc(O)c4O[C@H]2[C@@H](O)CC[C@H]3[C@H]1C5	C17H21NO3	unknown
+CCOc1ccc2c3c1O[C@H]1[C@@H](O)C=C[C@H]4[C@@H](C2)N(C)CC[C@@]341	C19H23NO3	unknown
+CN1CC[C@]23c4c5ccc(O)c4O[C@H]2[C@@H](O)CC[C@@]3(O)[C@H]1C5	C17H21NO4	unknown
+CC1=CC[C@H]2[C@H]3Cc4ccc(O)c5c4[C@@]2(CCN3C)[C@H]1O5	C18H21NO2	unknown
+CN1CC[C@]23c4c5ccc(O)c4O[C@H]2[C@@](C)(O)CC[C@H]3[C@H]1C5	C18H23NO3	unknown
+CN1CC[C@]23c4c5ccc(O)c4O[C@@]2(C)C(=O)CC[C@H]3[C@H]1C5	C18H21NO3	unknown
+CCCCCCCCCCCCCC(=O)O[C@H]1C=C[C@H]2[C@H]3Cc4ccc(OCc5ccccc5)c5c4[C@@]2(CCN3C)[C@H]1O5	C38H51NO4	unknown
+COc1ccc2c3c1O[C@H]1[C@@H](OC(=O)c4cccnc4)C=C[C@H]4[C@@H](C2)N(C)CC[C@@]341	C24H24N2O4	unknown
+CN1CC[C@]23c4c5ccc(OC(=O)c6cccnc6)c4O[C@H]2[C@@H](OC(=O)c2cccnc2)C=C[C@H]3[C@H]1C5	C29H25N3O5	unknown
+COc1ccc2c3c1O[C@H]1[C@@H](O)C=C[C@H]4[C@@H](C2)NCC[C@@]341	C17H19NO3	unknown
+Oc1ccc2c3c1O[C@H]1[C@@H](O)C=C[C@H]4[C@@H](C2)NCC[C@@]341	C16H17NO3	unknown
+CN1CC[C@]23c4c5ccc(OCCN6CCOCC6)c4O[C@H]2[C@@H](O)C=C[C@H]3[C@H]1C5	C23H30N2O4	unknown
+COc1ccc2c3c1O[C@H]1C(OC(C)=O)=CC[C@H]4[C@@H](C2)N(C)CC[C@]314	C20H23NO4	unknown
+CCC[C@@](C)(O)[C@H]1C[C@@]23C=C[C@]1(OC)[C@@H]1Oc4c(OC(C)=O)ccc5c4[C@@]12CCN(C)[C@@H]3C5	C27H35NO5	unknown
+CCC[C@@](C)(O)[C@H]1C[C@@]23C=C[C@]1(OC)[C@@H]1Oc4c(O)ccc5c4[C@@]12CCN(C)[C@@H]3C5	C25H33NO4	unknown
+CO[C@]12C=C[C@@]3(C[C@@H]1C(C)(C)O)[C@H]1Cc4ccc(O)c5c4[C@@]3(CCN1CC1CC1)[C@H]2O5	C26H33NO4	unknown
+CCCCCn1cc(CC(=O)C(C)(C)c2ccccc2)c2ccccc21	C24H29NO	cannabinoid,prophetic
+CCCCCN1C(=O)C(C(=O)NC(C)(C)c2ccccc2)=CC2CCCCCCC21	C26H38N2O2	cannabinoid,prophetic
+CCCCCn1nc(C(=O)NC2(c3ccccc3)CCCCC2)c2ccccc21	C25H31N3O	cannabinoid,prophetic
+CCCCCn1c(=O)c(C(=O)NC(C)(C)c2ccccc2)cc2ccccc21	C24H28N2O2	cannabinoid,prophetic
+CCCCCn1c(=O)c(C(=O)NC(C)(C)c2ccccc2)cc2cccnc21	C23H27N3O2	cannabinoid,prophetic
+CCCCCn1c(C(=O)NC(C)(C)c2ccccc2)nc2ccccc21	C22H27N3O	cannabinoid,prophetic
+CC(C)(C)c1nc2cc(C(=O)NC(C)(C)c3ccccc3)ccc2n1CC1CCCCC1	C28H37N3O	cannabinoid,prophetic
+CCCCCNc1cc(C(=O)NC(C)(C)c2ccccc2)ccc1OC	C22H30N2O2	cannabinoid,prophetic
+CCCCCNc1cc(/C=C/C(=O)NC(C)(C)c2ccccc2)ccc1OC	C24H32N2O2	cannabinoid,prophetic
+CC(C)(NC(=O)c1cc2cccnc2n(Cc2ccc(F)cc2)c1=O)c1ccccc1	C25H22FN3O2	cannabinoid,prophetic
+CCCCCn1c(=O)n(C(C)(C)c2ccccc2)c(=O)c2ccccc21	C22H26N2O2	cannabinoid,prophetic
+CCCCCOc1cccc2nc(C(=O)NC(C)(C)c3ccccc3)[nH]c12	C22H27N3O2	cannabinoid,prophetic
+CCCCCOc1c(C(=O)NC(C)(C)c2ccccc2)sc2ccccc12	C23H27NO2S	cannabinoid,prophetic
+CCCCCOc1cc(C(=O)NC(C)(C)c2ccccc2)ccc1-c1ccccc1F	C27H30FNO2	cannabinoid,prophetic
+CCCCCN1C(=O)/C(=N\NC(C)(C)c2ccccc2)c2ccccc21	C22H27N3O	cannabinoid,prophetic
+CCCCCn1nc(C(=O)OC(C)(C)c2ccccc2)c2ccccc21	C22H26N2O2	cannabinoid
+CCCCCn1nc(COC(C)(C)c2ccccc2)c2ccccc21	C22H28N2O	cannabinoid
+CC(C)(NC(=O)c1nn(CCCC(F)(F)F)c2ccccc12)c1ccccc1	C21H22F3N3O	cannabinoid,prophetic
+CC(C)(NC(=O)c1cn(S(=O)(=O)N2CCC(F)(F)CC2)c2ccccc12)c1ccccc1	C23H25F2N3O3S	cannabinoid,prophetic
+CC(C)(C)[C@H](NC(=O)c1cn(CC2CCCCC2)c2ccccc12)C(=O)NCC(N)=O	C24H34N4O3	cannabinoid,prophetic
+CC(C)(C)[C@H](NC(=O)c1cn(CC2CCCCC2)c2ccccc12)C(=O)NCCNS(=O)(=O)C1CC1	C27H40N4O4S	cannabinoid,prophetic
+CC(C)(NC(=O)c1nn(CC(=O)C2CCCCC2)c2ccccc12)c1ccccc1	C25H29N3O2	cannabinoid,prophetic
+O=C(c1ccc(Cn2ccnn2)c2ccccc12)c1cn(CCCCCF)c2ccccc12	C27H25FN4O	cannabinoid,prophetic
+CCCCCn1cc(-c2nc(CN(CC)CCCC(=O)NC3CC3)cs2)c2ccccc21	C26H36N4OS	cannabinoid,prophetic
+CCCCCn1nc(C(=O)NC(C)(C)c2ccccc2F)c2ccccc21	C22H26FN3O	cannabinoid,prophetic
+CCCCCn1cc(C(=O)NC(C)(C)c2ccccc2)c2ccsc21	C21H26N2OS	cannabinoid,prophetic
+CCCCCn1cc(C(=O)C(C)(C)c2ccccc2)c2ccccc21	C23H27NO	cannabinoid,prophetic
+CCCCCn1nc(C(=O)NC(C)(C)c2cccc(F)c2)c2ccccc21	C22H26FN3O	cannabinoid,prophetic
+CCCCCn1nc(C(=O)NC(C)(C)c2ccccc2)c2c1-c1sccc1C2	C23H27N3OS	cannabinoid,prophetic
+O=C(NCCCN1CCOCC1)c1nn(CC2CCOCC2)c2ccccc12	C21H30N4O3	cannabinoid,prophetic
+CCCCCn1nc(C(=O)NC(C)(C)c2cccc(Cl)c2Cl)c2ccccc21	C22H25Cl2N3O	cannabinoid,prophetic
+CCCCCN1C(=O)/C(=N\NC(=O)C(C)(C)c2ccccc2)c2ccccc21	C23H27N3O2	cannabinoid,prophetic
+O=C(NCCCn1ccnc1)c1nn(CC2CCOCC2)c2ccccc12	C20H25N5O2	cannabinoid,prophetic
+CCCCCn1nc(C(=O)NC(C)(C)c2cccs2)c2ccccc21	C20H25N3OS	cannabinoid,prophetic
+CCCCCc1nc2c(NC(C)(C)c3ccccc3)ncnc2n1-c1ccccc1F	C25H28FN5	cannabinoid,prophetic
+CCCCCn1nc(C(=O)NC2(C#N)CCOCC2)c2ccccc21	C19H24N4O2	cannabinoid,prophetic
+CCCCCn1cc(C(=O)NC(C)(C)c2cc(C(C)(C)C)no2)c2ccccc21	C24H33N3O2	cannabinoid,prophetic
+CCCCCn1cc(C(=O)NC(C)(C)c2ccccc2)cc1-c1ccccc1C	C26H32N2O	cannabinoid,prophetic
+CCCCCn1nc(-c2nc(C(C)(C)c3ccccc3)no2)c2ccccc21	C23H26N4O	cannabinoid,prophetic
+CCCCCn1cc(C(=O)NC(C)(C)c2noc(CN(C)CC(N)=O)n2)c2ccccc21	C23H32N6O3	cannabinoid,prophetic
+CC(C)(NC(=O)c1cc(-c2ccccc2F)n(CCCCCF)c1)c1ccccc1	C25H28F2N2O	cannabinoid,prophetic
+CCCCCn1nc(-c2nnc(C(C)(C)c3ccccc3)o2)c2ccccc21	C23H26N4O	cannabinoid,prophetic
+CCCCCn1cc(C(=O)NC(C)(C)c2nc(CN(C)CCOC)cs2)c2ccccc21	C25H36N4O2S	cannabinoid,prophetic
+CC(C)(NC(=O)c1cc(-c2cccs2)n(CCCCCF)c1)c1ccccc1	C23H27FN2OS	cannabinoid,prophetic
+CCCCCn1nc(-c2nnc(C3(c4ccc(Cl)cc4)CC3)o2)c2ccccc21	C23H23ClN4O	cannabinoid,prophetic
+CCCCCn1nc(C(=O)NC(C)(C)C23CC4CC(CC(C4)C2)C3)c2ccccc21	C26H37N3O	cannabinoid,prophetic
+CCCCCn1nc(C(=O)NC(C)(C)c2ccc(F)cc2)cc1-c1ccccc1C	C25H30FN3O	cannabinoid,prophetic
+CCCCCn1nc(-c2cn(C(C)(C)c3ccccc3)cn2)c2ccccc21	C24H28N4	cannabinoid,prophetic
+CCCCCn1nc(C(=O)NC(C)(C)CC(C)(C)C)c2ccccc21	C21H33N3O	cannabinoid,prophetic
+CCCCCc1nc(C(=O)NC(C)(C)c2ccccc2)sc1-c1ccccc1F	C24H27FN2OS	cannabinoid,prophetic
+CCCCCn1nc(-c2cn(C(C)(C)c3ccccc3)nn2)c2ccccc21	C23H27N5	cannabinoid,prophetic
+CCCCCn1cc(C(=O)NC(C)(C)c2ccccc2)c2ccc(C)cc21	C24H30N2O	cannabinoid,prophetic
+CC(C)(NC(=O)c1nc(CCCCCF)c(-c2ccccc2F)s1)c1ccc(F)cc1	C24H25F3N2OS	cannabinoid,prophetic
+CC(C)(NC(=O)c1nn(CCCC2CC2)c2ccccc12)c1ccccc1	C23H27N3O	cannabinoid,prophetic
+CCCCCn1cc(C(=O)NC(C)(C)c2ccccc2)c2ccc(F)cc21	C23H27FN2O	cannabinoid
+CCCCCC1=NN(C(=O)NC(C)(C)c2ccc(F)cc2)C(C)(C)C1c1ccccc1C	C27H36FN3O	cannabinoid,prophetic
+CC(C)(NC(=O)c1nn(CCC2CCC2)c2ccccc12)c1ccccc1	C23H27N3O	cannabinoid,prophetic
+CCCCCn1cc(C(=O)NC(C)(C)c2ccccc2)c2ccc(Sc3ccccc3)cc21	C29H32N2OS	cannabinoid,prophetic
+CCCCCc1nc(C(=O)NC(C)(C)c2ccccc2)c(C)n1-c1ccccc1F	C25H30FN3O	cannabinoid,prophetic
+COc1cccc2c(C(=O)NC(C)(C)c3ccccc3)cn(CC3CCOCC3)c12	C25H30N2O3	cannabinoid,prophetic
+CCCCCc1nc(C(=O)NC(C)(C)c2ccccc2)n(C)c1-c1ccccc1F	C25H30FN3O	cannabinoid,prophetic
+CC(C)(NC(=O)c1nn(Cc2ccncc2)c2ccccc12)c1ccccc1	C23H22N4O	cannabinoid,prophetic
+CC(C)(NC(=O)c1cn(CCCCCF)c2cnccc12)c1ccccc1	C22H26FN3O	cannabinoid,prophetic
+CCCCCn1nc(C(=O)NC(C)(C)c2ccccc2)nc1-c1ccccc1F	C23H27FN4O	cannabinoid,prophetic
+CC(C)(NC(=O)c1nn(-c2ccc(F)cc2F)c2ccccc12)c1ccccc1	C23H19F2N3O	cannabinoid,prophetic
+CCCCCc1cc(C(=O)NC(C)(C)c2ccccc2)ccc1-c1ccccc1F	C27H30FNO	cannabinoid,prophetic
+CC(C)(NC(=O)c1nn(CCCNS(C)(=O)=O)c2ccccc12)c1ccccc1	C21H26N4O3S	cannabinoid,prophetic
+CCCCCn1nc(C(=O)NC(C)(C)c2ccccc2)c2cccnc21	C21H26N4O	cannabinoid,prophetic
+CCCCOc1cc(C(=O)NC(C)(C)c2ccccc2)ccc1-c1ccccc1F	C26H28FNO2	cannabinoid,prophetic
+CC(C)(NC(=O)Cn1nc(C(=O)NC(C)(C)c2ccccc2)c2ccccc21)c1ccccc1	C28H30N4O2	cannabinoid,prophetic
+CCCCCn1nc(C(=O)NC(C)(C)c2ccccc2)c2c1C1CCC2C1	C23H31N3O	cannabinoid,prophetic
+CCCCCc1cc(C(=O)NC(C)(C)c2ccccc2)cnc1-c1ccccc1F	C26H29FN2O	cannabinoid,prophetic
+CCCCCc1nc(C(=O)NC(C)(C)c2ccccc2)ccc1-c1ccccc1F	C26H29FN2O	cannabinoid,prophetic
+CCCCCc1nc(C(=O)NC(C)(C)c2ccccc2)cnc1-c1ccccc1F	C25H28FN3O	cannabinoid,prophetic
+CCCCCOc1cccc(C(=O)NC(C)(C)c2ccccc2)c1	C21H27NO2	cannabinoid,prophetic
+CCCCCOc1cccc(/C=C/C(=O)NC(C)(C)c2ccccc2)c1	C23H29NO2	cannabinoid,prophetic
+CCCCCOc1ccc(C(=O)NC(C)(C)c2ccccc2)c2ccccc12	C25H29NO2	cannabinoid,prophetic
+CCCCCn1cccc(C(=O)NC(C)(C)c2ccccc2)c1=O	C20H26N2O2	cannabinoid,prophetic
+CCCCCn1c(-c2ccccc2F)ccc(C(=O)NC(C)(C)c2ccccc2)c1=O	C26H29FN2O2	cannabinoid,prophetic
+CCCCCn1c2c(cc(C(=O)NC(C)(C)c3ccccc3)c1=O)C1CCC2C1	C25H32N2O2	cannabinoid,prophetic
+CCCCCn1c2c(cc(C(=O)NC(C)(C)c3ccccc3)c1=O)CCCCCC2	C26H36N2O2	cannabinoid,prophetic
+Cc1ccc2c(=O)c(C(=O)NC(C)(C)c3ccccc3)cn(CCCCCF)c2n1	C24H28FN3O2	cannabinoid,prophetic
+CC(C)(NC(=O)c1cc2n(c1)[C@H](CCCCF)COC2)c1ccccc1	C21H27FN2O2	cannabinoid,prophetic
+CC(C)(NC(=O)c1cc2n(c1)[C@H](CCCCF)CCC2)c1ccccc1	C22H29FN2O	cannabinoid,prophetic
+CC(C)(NC(=O)c1cn2c3c(cccc13)OC[C@H]2C1CCOCC1)c1ccccc1	C25H28N2O3	cannabinoid,prophetic
+CC(C)(NC(=O)c1cn2c3c(cccc13)CC[C@H]2C1CCCCC1)c1ccccc1	C27H32N2O	cannabinoid,prophetic
+CC(C)(NC(=O)c1cn2c3c(cccc13)OC[C@H]2CCCCF)c1ccccc1	C24H27FN2O2	cannabinoid,prophetic
+CC(C)(C)[C@H](NC(=O)c1cn2c3c(cccc13)CCC2C1CCC(F)(F)CC1)C(N)=O	C24H31F2N3O2	cannabinoid,prophetic
+CC(C)(c1ccc(F)cc1)n1ccc2c(c1=O)c1cccc3c1n2[C@H](C1CCOCC1)CO3	C27H27FN2O3	cannabinoid,prophetic
+CC(C(=O)c1ccccc1)N1C(=O)c2ccccc2C1=O	C17H13NO3	beta-ketone
+Cc1[nH]c2ccccc2c1CCN	C11H14N2	tryptamine
+NC(CCC(=O)O)C(=O)O	C5H9NO4	unknown
+NC(Cc1c[nH]c2ccc(Cl)cc12)C(=O)O	C11H11ClN2O2	tryptamine
+NCCc1c[nH]c2ccc(Cl)cc12	C10H11ClN2	tryptamine
+NC(Cc1c[nH]c2c(Cl)cccc12)C(=O)O	C11H11ClN2O2	tryptamine
+NCCc1c[nH]c2c(Cl)cccc12	C10H11ClN2	tryptamine
+N[C@@H]1CC[C@@]2(O)[C@H]3Cc4ccc(O)c5c4[C@@]2(CCN3CC2CC2)[C@H]1O5	C20H26N2O3	unknown
+Oc1ccc2c3c1O[C@H]1c4[nH]c5c(c4C[C@@]4(O)[C@@H](C2)N(CC2CC2)CC[C@]314)C[C@@]1(O)[C@H]2Cc3ccc(O)c4c3[C@@]1(CCN2CC1CC1)[C@H]5O4	C40H43N3O6	unknown
+CN(C)C(=O)n1nnc(Cc2ccc(-c3ccccc3)cc2)n1	C17H17N5O	unknown
+COc1cccc2c1ccn2CCN(C)C	C13H18N2O	unknown
+COc1cccc2ccn(CCN(C)C)c12	C13H18N2O	unknown
+CN(C)CCn1ccc2c(OCc3ccccc3)cccc21	C19H22N2O	unknown
+CN(C)CCn1ccc2cc(OCc3ccccc3)ccc21	C19H22N2O	unknown
+CN(C)CCn1ccc2ccc(OCc3ccccc3)cc21	C19H22N2O	unknown
+CN(C)CCn1ccc2cccc(OCc3ccccc3)c21	C19H22N2O	unknown
+CN(C)CCn1ccc2c(F)cccc21	C12H15FN2	unknown
+CN(C)CCn1ccc2cc(F)ccc21	C12H15FN2	unknown
+CN(C)CCn1ccc2ccc(F)cc21	C12H15FN2	unknown
+CN(C)CCn1ccc2cccc(F)c21	C12H15FN2	unknown
+Cc1cc2ccccc2n1CCN(C)C	C13H18N2	unknown
+CN(C)CCn1ccc2c(F)cc(F)cc21	C12H14F2N2	unknown
+CN(C)CCn1ccc2ccc([N+](=O)[O-])cc21	C12H15N3O2	unknown
+CN(C)CCn1ccc2cc(Br)ccc21	C12H15BrN2	unknown
+CN(C)CCn1cc(C(=O)ON(C)C)c2ccccc21	C15H21N3O2	unknown
+CN(C)CCn1c2ccccc2c2ccccc21	C16H18N2	unknown
+CC(C)CCn1ccc2ccccc21	C13H17N	unknown
+CN(C)CCCn1ccc2ccccc21	C13H18N2	unknown
+CN(C)C(=O)Cn1ccc2ccccc21	C12H14N2O	unknown
+CCC(=O)c1ccccc1	C9H10O	unknown
+CCC(NC=O)c1ccccc1	C10H13NO	unknown
+COC(=O)C(C(C)=O)c1ccccc1	C11H12O3	unknown
+CC1(C(=O)O)OC1c1ccc2c(c1)OCO2	C11H10O5	unknown
+CC1(C(=O)O)OC1c1ccccc1	C10H10O3	unknown
+O=C(O)C(=O)Cc1c[nH]c2cc(F)ccc12	C11H8FNO3	unknown
+O=C(O)/C=C/c1c[nH]c2cc(F)ccc12	C11H8FNO2	unknown
+O=C(O)C(O)Cc1c[nH]c2cc(F)ccc12	C11H10FNO3	unknown
+CC(=O)NCCc1c[nH]c2cc(F)ccc12	C12H13FN2O	tryptamine
+O=Cc1c[nH]c2cc(F)ccc12	C9H6FNO	unknown
+O=C(O)CCc1c[nH]c2cc(F)ccc12	C11H10FNO2	unknown
+NC(=O)Cc1c[nH]c2cc(F)ccc12	C10H9FN2O	tryptamine
+NCCc1c[nH]c2cc(F)ccc12	C10H11FN2	tryptamine
+OCCc1c[nH]c2cc(F)ccc12	C10H10FNO	unknown
+Fc1ccc2cc[nH]c2c1	C8H6FN	unknown
+O=S(=O)(O)Oc1c[nH]c2cc(F)ccc12	C8H6FNO4S	unknown
+Cc1c[nH]c2cc(F)ccc12	C9H8FN	unknown
+O=C(O)Cc1c[nH]c2cc(F)ccc12	C10H8FNO2	unknown
+O=C(O)c1c[nH]c2cc(F)ccc12	C9H6FNO2	unknown
+NC(CC(=O)c1ccc(F)cc1NC=O)C(=O)O	C11H11FN2O4	unknown
+Nc1cc(F)ccc1C(=O)O	C7H6FNO2	unknown
+Nc1c(C(=O)CC(N)C(=O)O)ccc(F)c1O	C10H11FN2O4	unknown
+Nc1cc(F)ccc1C(=O)CC(N)C(=O)O	C10H11FN2O3	unknown
+Nc1c(C(=O)O)ccc(F)c1O	C7H6FNO3	unknown
+O=C(O)c1cc(O)c2ccc(F)cc2n1	C10H6FNO3	unknown
+O=C(O)c1cc(O)c2ccc(F)c(O)c2n1	C10H6FNO4	unknown
+COc1cc2c(CCNC(C)=O)c[nH]c2cc1F	C13H15FN2O2	tryptamine
+CC(=O)NCCc1c[nH]c2cc(F)c(O)cc12	C12H13FN2O2	tryptamine
+NC(Cc1c[nH]c2cc(F)c(O)cc12)C(=O)O	C11H11FN2O3	tryptamine
+NCCc1c[nH]c2cc(F)c(O)cc12	C10H11FN2O	tryptamine
+O=C(O)Cc1c[nH]c2cc(F)c(O)cc12	C10H8FNO3	unknown
+CNCCc1c[nH]c2cc(F)c(O)cc12	C11H13FN2O	tryptamine
+COc1cc2c(CCN)c[nH]c2cc1F	C11H13FN2O	tryptamine
+NC(Cc1c[nH]c2cc(F)ccc12)C(=O)O	C11H11FN2O2	tryptamine
+C[C@@H](O)[C@H](N)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@H](C(N)=O)[C@@H](C)O	C18H31N5O6	unknown
+C[C@@H](O)[C@H]1C[C@@H]2C[C@H]3c4[nH]c5ccccc5c4CCN(C2)[C@@H]13	C19H24N2O	unknown
+Clc1ccc([C@@H]2C[C@H]3CC[C@@H]2N3)cn1	C11H13ClN2	unknown
+C[N+](C)(CCl)CCc1c[nH]c2cc(Br)c(Br)cc12	C13H16Br2ClN2	tryptamine
+C[N+](C)([O-])CCc1c[nH]c2cc(Br)c(Br)cc12	C12H14Br2N2O	tryptamine
+CN1CCc2c([nH]c3cc(Br)c(Br)cc23)C1	C12H12Br2N2	unknown
+CN(C)CC[C@]1(O)C(=O)Nc2cc(Br)c(Br)cc21	C12H14Br2N2O2	unknown
+CCCCCc1cc(OC)c2c(c1)OC(C)(C)[C@@H]1CCC(C)=C[C@@H]21	C22H32O2	cannabinoid
+NCCC(=O)c1cc(Br)c(Br)cc1N	C9H10Br2N2O	unknown
+COc1c(N)c(C(=O)CCN)cc(Br)c1Br	C10H12Br2N2O2	unknown
+CNCCc1cc(Br)c(OC)c(Br)c1	C10H13Br2NO	unknown
+CNCCc1c[nH]c2cc(Br)ccc12	C11H13BrN2	tryptamine
+NCCc1c[nH]c2cc(Br)ccc12	C10H11BrN2	tryptamine
+NCCC(=O)c1ccc(Br)cc1N	C9H11BrN2O	unknown
+C=C1CC[C@@H]2[C@@H](C1)c1c(O)cc(CCCCC)cc1OC2(C)C	C21H30O2	cannabinoid
+CCCCCc1cc2c(c(O)c1C(=O)O)C=CC(C)(CCC=C(C)C)O2	C22H30O4	unknown
+CCCCCc1cc2c(c(O)c1C(=O)O)[C@@H]1CC(C)=CC[C@H]1C(C)(C)O2	C22H30O4	cannabinoid
+CCCCCc1cc(O)cc(O)c1C(=O)O	C12H16O4	unknown
+CCCCCc1cc(O)cc(O)c1	C11H16O2	unknown
+CCCN(CCC)CCc1c(C)[nH]c2ccccc12	C17H26N2	tryptamine
+CN(C)c1c[nH]c2ccc(OCc3ccccc3)cc12	C17H18N2O	unknown
+Cc1cc2c(cc1CCN)OCO2	C10H13NO2	unknown
+CNCCc1cc2c(cc1C)OCO2	C11H15NO2	unknown
+Cc1cc(CCN)cc2c1OCO2	C10H13NO2	unknown
+CNCCc1cc(C)c2c(c1)OCO2	C11H15NO2	unknown
+CNC(C)Cc1cc(C)c2c(c1)OCO2	C12H17NO2	unknown
+Cc1c(CCN)ccc2c1OCO2	C10H13NO2	unknown
+CNCCc1ccc2c(c1C)OCO2	C11H15NO2	unknown
+NCCc1cc2c(cc1Br)OCO2	C9H10BrNO2	unknown
+CNCCc1cc2c(cc1Br)OCO2	C10H12BrNO2	unknown
+CNCCc1cc(Br)c2c(c1)OCO2	C10H12BrNO2	unknown
+CC(N)Cc1cc(Br)c2c(c1)OCO2	C10H12BrNO2	unknown
+CNC(C)Cc1cc(Br)c2c(c1)OCO2	C11H14BrNO2	unknown
+NCCc1ccc2c(c1Br)OCO2	C9H10BrNO2	unknown
+CNCCc1ccc2c(c1Br)OCO2	C10H12BrNO2	unknown
+CC(N)Cc1ccc2c(c1Br)OCO2	C10H12BrNO2	unknown
+CNC(C)Cc1ccc2c(c1Br)OCO2	C11H14BrNO2	unknown
+NCCc1ccc2c(c1)OCS2	C9H11NOS	unknown
+CC(N)Cc1ccc2c(c1)OCS2	C10H13NOS	unknown
+CNCCc1ccc2c(c1)OCS2	C10H13NOS	unknown
+CNC(C)Cc1ccc2c(c1)OCS2	C11H15NOS	unknown
+NCCc1ccc2c(c1)SCO2	C9H11NOS	unknown
+CC(N)Cc1ccc2c(c1)SCO2	C10H13NOS	unknown
+CNCCc1ccc2c(c1)SCO2	C10H13NOS	unknown
+CNC(C)Cc1ccc2c(c1)SCO2	C11H15NOS	unknown
+NCCc1ccc2c(c1)SCS2	C9H11NS2	unknown
+CC(N)Cc1ccc2c(c1)SCS2	C10H13NS2	unknown
+CNCCc1ccc2c(c1)SCS2	C10H13NS2	unknown
+CNC(C)Cc1ccc2c(c1)SCS2	C11H15NS2	unknown
+NCCc1ccc2c(c1)NCO2	C9H12N2O	unknown
+CC(N)Cc1ccc2c(c1)NCO2	C10H14N2O	unknown
+CNCCc1ccc2c(c1)NCO2	C10H14N2O	unknown
+CNC(C)Cc1ccc2c(c1)NCO2	C11H16N2O	unknown
+NCCc1ccc2c(c1)OCN2	C9H12N2O	unknown
+CC(N)Cc1ccc2c(c1)OCN2	C10H14N2O	unknown
+CNCCc1ccc2c(c1)OCN2	C10H14N2O	unknown
+CNC(C)Cc1ccc2c(c1)OCN2	C11H16N2O	unknown
+NCCc1ccc2c(c1)NCN2	C9H13N3	unknown
+CC(N)Cc1ccc2c(c1)NCN2	C10H15N3	unknown
+CNCCc1ccc2c(c1)NCN2	C10H15N3	unknown
+CNC(C)Cc1ccc2c(c1)NCN2	C11H17N3	unknown
+NCCc1ccc2ocnc2c1	C9H10N2O	unknown
+CNCCc1ccc2ocnc2c1	C10H12N2O	unknown
+CNC(C)Cc1ccc2ocnc2c1	C11H14N2O	unknown
+NCCc1ccc2scnc2c1	C9H10N2S	unknown
+CNCCc1ccc2scnc2c1	C10H12N2S	unknown
+CNC(C)Cc1ccc2scnc2c1	C11H14N2S	unknown
+NCCc1ccc2ncoc2c1	C9H10N2O	unknown
+CNCCc1ccc2ncoc2c1	C10H12N2O	unknown
+CNC(C)Cc1ccc2ncoc2c1	C11H14N2O	unknown
+NCCc1ccc2ncsc2c1	C9H10N2S	unknown
+CNCCc1ccc2ncsc2c1	C10H12N2S	unknown
+CNC(C)Cc1ccc2ncsc2c1	C11H14N2S	unknown
+CCCCCc1cc(O)c(C/C=C(\C)CCC=C(C)C)c(O)c1C(=O)O	C22H32O4	unknown
+C[N+]1(C)CC[C@@]2(O)c3cc(Br)c(Br)cc3N[C@H]21	C12H15Br2N2O	unknown
+O=C(c1cn(CCCCCF)c2ccccc12)C12C3C4C5C3C1C5C42	C22H22FNO	cannabinoid,prophetic
+CCC1=C[C@@H]2CN3CCc4c([nH]c5ccccc45)[C@@](C(=O)OC)(C2)[C@@H]13	C21H24N2O2	unknown
+O=C(O)C(=O)c1c[nH]c2ccccc12	C10H7NO3	unknown
+C[N+](C)(C)CCc1c[nH]c2cccc(O)c12	C13H18N2O	tryptamine
+OC(CCN1CCCC1)(c1ccccc1)C1CCCCC1	C19H29NO	unknown
+CN1C2CCC1CC(OC(c1ccccc1)c1ccccc1)C2	C21H25NO	unknown
+CN1C2CCC1CC(OC(=O)[C@H](CO)c1ccccc1)C2	C17H23NO3	unknown
+CCC(=O)OC(Cc1ccccc1)(c1ccccc1)C(C)CN(C)C	C22H29NO2	unknown
+CC(C)=CCN1CC[C@@]2(C)c3cc(O)ccc3C[C@@H]1[C@@H]2C	C19H27NO	unknown
+Clc1ccccn1	C5H4ClN	unknown
+N#CC(c1ccccc1)c1ccccn1	C13H10N2	unknown
+NC(=O)C(c1ccccc1)c1ccccn1	C13H12N2O	unknown
+COC(=O)C(c1ccccc1)C1CCCC(=O)N1	C14H17NO3	unknown
+CCOC(=O)c1ncn2c1cc(C(=O)N(C)C)c1ccccc12	C17H17N3O3	unknown
+CCC(NC(=O)c1nn(CCCCC#N)c2ccccc12)c1ccccc1	C22H24N4O	cannabinoid
+COC(=O)c1cccc(CCN(C)Cc2ccccc2)c1	C18H21NO2	unknown
+O=C(C1CC1)N(c1cccc(F)c1)C1CCN(Cc2ccccc2)CC1	C22H25FN2O	fentanyl
+Fc1cccc(NC2CCN(Cc3ccccc3)CC2)c1	C18H21FN2	unknown
+CCC(NC)C(=O)c1ccc(Cl)cc1	C11H14ClNO	beta-ketone
+Clc1ccccc1C1=NCc2nncn2-c2ccc(Br)cc21	C16H10BrClN4	aryldiazepine
+CCC(=O)N(c1ccccc1)C1(COC)CCNCC1	C16H24N2O2	fentanyl
+Fc1cccc(NC2CCN(CCc3ccccc3)CC2)c1	C19H23FN2	fentanyl
+CCC(=O)c1ccc(C)cc1	C10H12O	unknown
+CC(C)Oc1ccc2c(=O)c(-c3ccccc3)coc2c1	C18H16O3	unknown
+COC(=O)C(NC(=O)c1n[nH]c2ccccc12)C(C)(C)C	C15H19N3O3	cannabinoid
+CSc1ccc(C(=O)C(C)NCc2ccccc2)cc1	C17H19NOS	beta-ketone
+CCNC(C(=O)c1ccccc1)C(C)(C)C	C14H21NO	beta-ketone
+CCCC(C(=O)c1cc(C)ccc1C)N1CCCC1	C17H25NO	beta-ketone
+CCCCn1nc(C(=O)NC(C(N)=O)C(C)(C)C)c2ccccc21	C18H26N4O2	cannabinoid
+CCCCCC(C(=O)c1ccc2c(c1)OCO2)N1CCCC1	C18H25NO3	beta-ketone
+Brc1ccc(NC2CCN(CCc3ccccc3)CC2)cc1	C19H23BrN2	fentanyl
+COc1ccc(NC2CCN(CCc3ccccc3)CC2)cc1	C20H26N2O	fentanyl
+CC(N)Cc1cccc2sccc12	C11H13NS	unknown
+CN(C)C1(CNC(=O)c2ccc(F)cc2)CCCCC1	C16H23FN2O	unknown
+CN(C)C1(CNC(=O)c2ccc(C(F)(F)F)cc2)CCCCC1	C17H23F3N2O	unknown
+COc1ccc(C(=O)NCC2(N(C)C)CCCCC2)cc1	C17H26N2O2	unknown
+CN(C)C1(CNC(=O)c2ccc(F)c(F)c2)CCCCC1	C16H22F2N2O	unknown
+CC(=O)NCCc1c[nH]c2cccc(O)c12	C12H14N2O2	tryptamine
+OCc1ccc(-c2nccc3c2[nH]c2ccccc23)o1	C16H12N2O2	unknown
+C[C@@H](O)c1nccc2c1[nH]c1ccccc12	C13H12N2O	unknown
+C[C@H](O)c1nccc2c1[nH]c1ccccc12	C13H12N2O	unknown
+CN(C)CCc1c[nH]c2ccc(-c3ccc4[nH]cc(CCN(C)C)c4c3O)c(O)c12	C24H30N4O2	tryptamine
+CN(C)CCc1c[nH]c2c1C(=O)/C(=C1\C=Cc3[nH]cc(CCN(C)C)c3C1=O)C=C2	C24H28N4O2	tryptamine
+COc1ccc(CC(C)Br)cc1OC	C11H15BrO2	unknown
+CCC(=O)c1ccc(OC)cc1	C10H12O2	unknown
+O=C(O)/C=C/c1ccc2c(c1)OCO2	C10H8O4	unknown
+CCC(=O)c1ccc2c(c1)OCO2	C10H10O3	unknown
+C=CCc1cccc2c1OCO2	C10H10O2	unknown
+CN(C)CCc1c[nH]c2ccc(O)c(O)c12	C12H16N2O2	tryptamine
+CN(C)CCc1c[nH]c2ccc(-c3cc(O)c4[nH]cc(CCN(C)C)c4c3O)c(O)c12	C24H30N4O3	tryptamine
+COc1cc(-c2ccc3[nH]cc(CCN(C)C)c3c2O)c(O)c2c(CCN(C)C)c[nH]c12	C25H32N4O3	tryptamine
+CN(C)CCc1c[nH]c2c1C(=O)/C(=C1\C=C(O)c3[nH]cc(CCN(C)C)c3C1=O)C=C2	C24H28N4O3	tryptamine
+COC1=C/C(=C2/C=Cc3[nH]cc(CCN(C)C)c3C2=O)C(=O)c2c(CCN(C)C)c[nH]c21	C25H30N4O3	tryptamine
+CN(C)CCc1c[nH]c2c1C(=O)C(=O)C(c1[nH]c3cccc(O)c3c1CCN(C)C)=C2	C24H28N4O3	tryptamine
+CN(C)CCc1c[nH]c2cc(-c3[nH]c4cccc(O)c4c3CCN(C)C)c(O)c(O)c12	C24H30N4O3	tryptamine
+COc1cc(OCc2ccccc2)c(OC)cc1CCN	C17H21NO3	unknown
+CCC(=O)N(c1ccccc1)C1CCN(CC(F)c2ccccc2)CC1	C22H27FN2O	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CC(F)(F)c2ccccc2)CC1	C22H26F2N2O	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CC(F)c2ccccc2F)CC1	C22H26F2N2O	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CC(F)c2cccc(F)c2)CC1	C22H26F2N2O	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CC(F)c2ccc(F)cc2)CC1	C22H26F2N2O	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CC(F)c2ccc(F)cc2F)CC1	C22H25F3N2O	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CC(=O)c2ccccc2F)CC1	C22H25FN2O2	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CC(O)c2ccccc2F)CC1	C22H27FN2O2	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CC(O)c2cccc(F)c2)CC1	C22H27FN2O2	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CC(=O)c2ccc(F)cc2)CC1	C22H25FN2O2	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CC(O)c2ccc(F)cc2F)CC1	C22H26F2N2O2	fentanyl
+CC(=O)N(c1ccccc1F)C1CCN(CCc2ccccc2)CC1	C21H25FN2O	fentanyl
+CCC(=O)N(c1ccccc1F)C1CCN(CCc2ccc(OC)cc2)CC1	C23H29FN2O2	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CC(=O)c2ccc(F)cc2F)CC1	C22H24F2N2O2	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CC(O)c2c(F)cccc2F)CC1	C22H26F2N2O2	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CC(O)c2cc(F)cc(F)c2)CC1	C22H26F2N2O2	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CC(O)c2c(F)cc(F)cc2F)CC1	C22H25F3N2O2	fentanyl
+O=C(CCO)N(c1ccccc1)C1CCN(CCc2ccccc2)CC1	C22H28N2O2	fentanyl
+CCCC(=O)N(c1ccccc1)C1CCNCC1	C15H22N2O	fentanyl
+CCCC(=O)N(c1ccc(F)cc1)C1CCN(Cc2ccccc2)CC1	C22H27FN2O	fentanyl
+CCC(=O)N(c1ccccc1)C1CCN(CCc2ccc(N=C=S)cc2)CC1	C23H27N3OS	fentanyl
+CCC(=O)N(c1ccccc1)C1(C(=O)OC)CCN(CC)CC1	C18H26N2O3	fentanyl
+CCC(=O)N(c1ccccc1)C1(C(=O)OC)CCN(C(C)C)CC1	C19H28N2O3	fentanyl
+CCC(=O)N(c1ccccc1)C1(C(=O)OC)CCNCC1	C16H22N2O3	fentanyl
+CCCN1CCC(C(=O)OC)(N(C(=O)CC)c2ccccc2)CC1	C19H28N2O3	fentanyl
+C=CC(=O)N(c1ccccc1C)C1CCN(CCc2ccccc2)CC1	C23H28N2O	fentanyl
+CN(C)CCc1c[nH]c2ccc(C#N)cc12	C13H15N3	tryptamine
+Cc1ccc(C(=O)Oc2cccc3cccnc23)cc1C(=O)N1CCCCC1	C23H22N2O3	cannabinoid
+CC(N)Cc1cc2ccccc2s1	C11H13NS	unknown
+CC(N)Cc1cccc2ccsc12	C11H13NS	unknown
+COC(=O)[C@@H](NC(=O)c1nn(CCCC(C)F)c2ccccc12)C(C)(C)C	C20H28FN3O3	cannabinoid
+C[C@]12CCC(=O)C=C1CC[C@@H]1[C@@H]2CC[C@]2(C)C(=O)CC[C@@H]12	C19H26O2	unknown
+C[C@]12CC[C@H]3[C@@H](C[C@H](Cl)C4=CC(=O)CC[C@@]43C)[C@@H]1CC[C@@H]2O	C19H27ClO2	unknown
+O=C(c1cccc(Cl)c1Cl)c1nc(CN2CCC(F)(F)CC2)c2ccccn12	C20H17Cl2F2N3O	cannabinoid
+O=C(NCC1(CO)CCCC1)c1nc(CN2CCC(F)(F)CC2)n2ccccc12	C21H28F2N4O2	cannabinoid
+O=C1/C(=C/c2cn(Cc3ccc(F)cc3)c3ccccc23)N2CCC1CC2	C23H21FN2O	cannabinoid
+CNC(C)Cc1ccc(C)s1	C9H15NS	unknown
+CNC(=O)[C@@H](NC(=O)c1nn(Cc2ccc(Cl)cc2Cl)c2ccccc12)C(C)(C)C	C22H24Cl2N4O2	cannabinoid
+CC(I)Cc1ccc2c(c1)OCO2	C10H11IO2	unknown
+CC(Cl)Cc1ccc2c(c1)OCO2	C10H11ClO2	unknown
+COc1c(CC(C)Br)cc2c(c1OC)OCO2	C12H15BrO4	unknown
+COc1cc(CC(C)Br)cc(OC)c1O	C11H15BrO3	unknown
+O=C(CC(c1ccccc1)N1CCCCC1)N1CCCCC1	C19H28N2O	unknown
+CC(=O)OC(c1ccccc1)C(C)N	C11H15NO2	unknown
+C/C(=C\c1ccccc1)C(=O)O	C10H10O2	unknown
+COc1ccc(/C=C(\C)C(=O)O)cc1OC	C12H14O4	unknown
+COc1ccc(CC(C)C(=O)O)cc1OC	C12H16O4	unknown
+CC(Cc1ccccc1)C(=O)O	C10H12O2	unknown
+C/C(Cc1ccccc1)=N\O	C9H11NO	unknown
+COc1ccc(C)cc1CC(C)=O	C11H14O2	unknown
+O=CCc1ccc(Cl)cc1	C8H7ClO	unknown
+Cc1ccc(CC=O)cc1	C9H10O	unknown
+COc1ccc(CC=O)cc1	C9H10O2	unknown
+O=CCc1ccco1	C6H6O2	unknown
+O=CCc1cccc2ccccc12	C12H10O	unknown
+O=CCc1ccc2c(c1)OCO2	C9H8O3	unknown
+CCC(=O)Cc1ccccc1	C10H12O	unknown
+CCCC(=O)Cc1ccccc1	C11H14O	unknown
+CC(=O)Cc1ccccc1F	C9H9FO	unknown
+CC(=O)Cc1ccc(Br)cc1	C9H9BrO	unknown
+CC(=O)Cc1ccc(O)cc1	C9H10O2	unknown
+CC(=O)Cc1ccccc1O	C9H10O2	unknown
+COc1ccc(OC)c(CC(C)=O)c1	C11H14O3	unknown
+CC(=O)Cc1ccc(OC(C)=O)cc1	C11H12O3	unknown
+COc1ccc(CC(C)=O)c(OC)c1	C11H14O3	unknown
+CC(=O)Cc1cc(C)ccc1C	C11H14O	unknown
+CC(=O)Cc1cccc(C(F)(F)F)c1	C10H9F3O	unknown
+CC(=O)C(C)c1ccccc1	C10H12O	unknown
+CCC(=O)C(C)c1ccccc1	C11H14O	unknown
+CCC(C(C)=O)c1ccccc1	C11H14O	unknown
+CCC(=O)C(CC)c1ccccc1	C12H16O	unknown
+CCCC(C(C)=O)c1ccccc1	C12H16O	unknown
+CCCC(C(=O)CC)c1ccccc1	C13H18O	unknown
+COc1cccc(CC(C)=O)c1	C10H12O2	unknown
+CC(=O)Cc1cccc2ccccc12	C13H12O	unknown
+CC(=O)Cc1ccc(F)cc1	C9H9FO	unknown
+COc1ccc(C(C)C(C)=O)cc1	C11H14O2	unknown
+CC(=O)C(C)c1cccc(C(F)(F)F)c1	C11H11F3O	unknown
+CC(=O)C(C)c1ccc(F)cc1	C10H11FO	unknown
+CC(=O)C(C)c1cccnc1	C9H11NO	unknown
+CC(C(O)c1ccccc1)[N+](=O)[O-]	C9H11NO3	unknown
+CC(=O)C(O)c1ccccc1	C9H10O2	unknown
+CC(=O)N(C)[C@@H](C)[C@H](O)c1ccccc1	C12H17NO2	unknown
+CN[C@@H](C)[C@H](OC(C)=O)c1ccccc1	C12H17NO2	unknown
+CC(=O)N(C)[C@@H](C)[C@@H](O)c1ccccc1	C12H17NO2	unknown
+CN[C@@H](C)[C@@H](OC(C)=O)c1ccccc1	C12H17NO2	unknown
+NC(CO)Cc1ccccc1	C9H13NO	unknown
+CC(NC=O)C(O)c1ccccc1	C10H13NO2	unknown
+CC(Br)C(=O)c1ccccc1	C9H9BrO	unknown
+CCN(CC)CCc1c[nH]c2cccc(OCc3ccccc3)c12	C21H26N2O	tryptamine
+CCN(CC)CCc1cn(C)c2ccccc12	C15H22N2	tryptamine
+CCN(CC)C(C)Cc1c[nH]c2ccccc12	C15H22N2	tryptamine
+CCN(C)CCc1c[nH]c2cccc(OCc3ccccc3)c12	C20H24N2O	tryptamine
+COc1ccc2[nH]cc(CCN(C)C)c2c1[N+](=O)[O-]	C13H17N3O3	tryptamine
+CC(=O)c1ccc(Cl)c2[nH]c(C(=O)O)c(CCN)c12	C13H13ClN2O3	tryptamine
+COc1ccc(CCN)c(C)c1	C10H15NO	unknown
+COc1cc(C=O)c(SC)cc1OC	C10H12O3S	unknown
+COc1cc(/C=C(\C)[N+](=O)[O-])c(SC)cc1OC	C12H15NO4S	unknown
+COc1cc(OC)c(SC)cc1C=O	C10H12O3S	unknown
+COc1cc(OC)c(SC)cc1/C=C(\C)[N+](=O)[O-]	C12H15NO4S	unknown
+C/C(=C\c1ccc(F)cc1)[N+](=O)[O-]	C9H8FNO2	unknown
+C/C(=C\c1ccc(C(F)(F)F)cc1)N(O)O	C10H10F3NO2	unknown
+COc1cc(/C=C(\C)[N+](=O)[O-])c(OC)cc1C	C12H15NO4	unknown
+COc1cc(C=O)c(OC)cc1C	C10H12O3	unknown
+C/C=C\c1cc(OC)c(C)cc1OC	C12H16O2	unknown
+O=Cc1ccc2c(c1)CCC2	C10H10O	unknown
+C/C(=C\c1ccc2c(c1)CCC2)[N+](=O)[O-]	C12H13NO2	unknown
+C/C(=C\c1cc(C)c2c(c1)OCO2)[N+](=O)[O-]	C11H11NO4	unknown
+COc1cc(CC(C)=O)ccc1C	C11H14O2	unknown
+Cc1ccc(C=O)cc1	C8H8O	unknown
+O=Cc1cccc(Br)c1	C7H5BrO	unknown
+O=Cc1ccc(Cl)cc1	C7H5ClO	unknown
+COc1ccc(C=O)c(OC(C)C)c1	C11H14O3	unknown
+CCCCOc1cc(OC)ccc1C=O	C12H16O3	unknown
+CCCCCCCCOc1cc(OC)ccc1C=O	C16H24O3	unknown
+COc1ccc(C=O)c(OCCCl)c1	C10H11ClO3	unknown
+C#CCOc1cc(OC)ccc1C=O	C11H10O3	unknown
+COc1ccc(C=O)c(OCc2ccccc2)c1	C15H14O3	unknown
+C=CCOc1cc(OC)ccc1C=O	C11H12O3	unknown
+CCOC(=O)COc1cc(OC)ccc1C=O	C12H14O5	unknown
+CCOc1cc(O)ccc1C=O	C9H10O3	unknown
+C#CCOc1ccc(C=O)c(OCC)c1	C12H12O3	unknown
+CCOc1cc(OCc2ccccc2)ccc1C=O	C16H16O3	unknown
+COc1cc([N+](=O)[O-])c(OC)cc1C=O	C9H9NO5	unknown
+COc1cc(SCCO)c(OC)cc1C=O	C11H14O4S	unknown
+COc1ccc(SC)c(C=O)c1	C9H10O2S	unknown
+COc1cc(SC)c(C=O)cc1OCc1ccccc1	C16H16O3S	unknown
+CSc1cc2c(cc1C=O)OCO2	C9H8O3S	unknown
+COc1cc(C=O)c(SC)cc1C	C10H12O2S	unknown
+COc1ccc(SCc2ccccc2)c(C=O)c1	C15H14O2S	unknown
+COc1cc(C=O)c(SCc2ccccc2)cc1OC	C16H16O3S	unknown
+COc1cc(SCc2ccccc2)c(C=O)cc1OCc1ccccc1	C22H20O3S	unknown
+O=Cc1cc2c(cc1SCc1ccccc1)OCO2	C15H12O3S	unknown
+COc1cc(C=O)c(SCc2ccccc2)cc1C	C16H16O2S	unknown
+COc1cccc(/C=C/[N+](=O)[O-])c1OC	C10H11NO4	unknown
+COc1cc(OC)c(/C=C/[N+](=O)[O-])c(OC)c1	C11H13NO5	unknown
+CC(=O)Nc1ccc(/C=C/[N+](=O)[O-])cc1	C10H10N2O3	unknown
+CSc1ccc(/C=C/[N+](=O)[O-])cc1	C9H9NO2S	unknown
+O=[N+]([O-])/C=C/c1c[nH]c2ccccc12	C10H8N2O2	unknown
+O=[N+]([O-])/C=C/c1ccc(Cl)cc1	C8H6ClNO2	unknown
+O=[N+]([O-])/C=C/c1ccc([N+](=O)[O-])cc1	C8H6N2O4	unknown
+O=[N+]([O-])/C=C/c1cccc([N+](=O)[O-])c1	C8H6N2O4	unknown
+COc1cc(C=O)c(OC)cc1I	C9H9IO3	unknown
+COc1cc(/C=C(\C)[N+](=O)[O-])c(OC)cc1I	C11H12INO4	unknown
+COc1cc(CC(C)=O)c(OC)cc1I	C11H13IO3	unknown
+O=Cc1ccc(C=O)cc1	C8H6O2	unknown
+CCCCOc1ccccc1C=O	C11H14O2	unknown
+CCC(C)Oc1ccccc1C=O	C11H14O2	unknown
+O=Cc1ccc(O)cc1	C7H6O2	unknown
+O=Cc1cccc(O)c1	C7H6O2	unknown
+O=Cc1ccccc1O	C7H6O2	unknown
+O=Cc1ccccc1Cl	C7H5ClO	unknown
+O=Cc1cc(Br)ccc1Br	C7H4Br2O	unknown
+O=Cc1cccc([N+](=O)[O-])c1	C7H5NO3	unknown
+Cc1ccccc1C=O	C8H8O	unknown
+Cc1cccc(C=O)c1	C8H8O	unknown
+C=CCc1ccc(OC)c(OC)c1OC	C12H16O3	unknown
+C/C=C/c1ccc(OC)c(OC)c1OC	C12H16O3	unknown
+C/C=C\c1ccc(OC)c(OC)c1OC	C12H16O3	unknown
+C=CCc1cc(OC)cc(OC)c1OC	C12H16O3	unknown
+C/C=C/c1cc(OC)cc(OC)c1OC	C12H16O3	unknown
+C/C=C\c1cc(OC)cc(OC)c1OC	C12H16O3	unknown
+C=CCc1c(OC)ccc(OC)c1OC	C12H16O3	unknown
+C/C=C/c1c(OC)ccc(OC)c1OC	C12H16O3	unknown
+C/C=C\c1c(OC)ccc(OC)c1OC	C12H16O3	unknown
+C=CCc1c(OC)cc(OC)cc1OC	C12H16O3	unknown
+C/C=C/c1c(OC)cc(OC)cc1OC	C12H16O3	unknown
+C/C=C\c1c(OC)cc(OC)cc1OC	C12H16O3	unknown
+O=[N+]([O-])/C=C/c1ccc(O)cc1	C8H7NO3	unknown
+COc1ccccc1/C=C/[N+](=O)[O-]	C9H9NO3	unknown
+CCOc1ccccc1/C=C/[N+](=O)[O-]	C10H11NO3	unknown
+CCOc1cc(/C=C/[N+](=O)[O-])ccc1O	C10H11NO4	unknown
+COc1cccc(/C=C/[N+](=O)[O-])c1O	C9H9NO4	unknown
+C/C(=C\c1ccc(O)cc1)[N+](=O)[O-]	C9H9NO3	unknown
+CCOc1cc(/C=C(\C)[N+](=O)[O-])ccc1O	C11H13NO4	unknown
+CC/C(=C\c1cccc(OC)c1OC)[N+](=O)[O-]	C12H15NO4	unknown
+CC/C(=C\c1ccc(OC)c(OC)c1)[N+](=O)[O-]	C12H15NO4	unknown
+CC/C(=C\c1ccc(O)c(OC)c1)[N+](=O)[O-]	C11H13NO4	unknown
+CC/C(=C\c1ccccc1OC)[N+](=O)[O-]	C11H13NO3	unknown
+CCOc1ccccc1/C=C(\CC)[N+](=O)[O-]	C12H15NO3	unknown
+CC/C(=C\c1cccc(OC)c1)[N+](=O)[O-]	C11H13NO3	unknown
+CC(C)CNCCc1ccccc1	C12H19N	unknown
+CCCCNCCc1ccccc1	C12H19N	unknown
+COc1ccc(C/C=N/O)cc1OC	C10H13NO3	unknown
+O/N=C/Cc1ccc2c(c1)OCO2	C9H9NO3	unknown
+COc1ccc(C/C=N/O)cc1	C9H11NO2	unknown
+O/N=C/Cc1ccccc1	C8H9NO	unknown
+O=Cc1cc2c(cc1O)OCO2	C8H6O4	unknown
+COc1cc(O)c(C=O)cc1OC	C9H10O4	unknown
+COc1cc(CC(=O)O)cc2c1OCO2	C10H10O5	unknown
+O=Cc1cc(O)c2c(c1)OCO2	C8H6O4	unknown
+CCOc1c(O)cc(C=O)cc1OC	C10H12O4	unknown
+CCOc1cc(C=O)cc(OC)c1OC	C11H14O4	unknown
+COc1cc(C=O)cc(O)c1O	C8H8O4	unknown
+COc1c(CC(C)=O)cc2c(c1OC)OCO2	C12H14O5	unknown
+CNC(C)Cc1cc2c(c(OC)c1OC)OCO2	C13H19NO4	unknown
+COc1c(C/C(C)=N/O)cc2c(c1OC)OCO2	C12H15NO5	unknown
+COc1c(CC(C)N)c(Br)c2c(c1OC)OCO2	C12H16BrNO4	unknown
+C=CCc1cc(OC)c(OC)c2c1OCO2	C12H14O4	unknown
+C=CCc1cc2c(c(SC)c1OC)OCO2	C12H14O3S	unknown
+C=CCc1cc(OC)c(OC)c(O)c1O	C11H14O4	unknown
+COc1cc(OC)c(OC)cc1C/C(C)=N/O	C12H17NO4	unknown
+COc1cc(C=O)cc(Br)c1O	C8H7BrO3	unknown
+CCOc1c(OC)cc(C=O)cc1OC	C11H14O4	unknown
+COc1cc(C=O)cc(I)c1O	C8H7IO3	unknown
+COc1cc(CC[N+](=O)[O-])cc(OC)c1OC	C11H15NO5	unknown
+O=Cc1cc(Br)c(O)c(Br)c1	C7H4Br2O2	unknown
+COc1cc(C=O)cc(Br)c1OC	C9H9BrO3	unknown
+CC(Cc1ccccc1F)[N+](=O)[O-]	C9H10FNO2	unknown
+COc1cc(OC)c(OC)cc1CC(C)[N+](=O)[O-]	C12H17NO5	unknown
+COc1ccc(OC)c(CC=O)c1	C10H12O3	unknown
+COc1ccc(OC)c(C/C=N/O)c1	C10H13NO3	unknown
+COc1cc(C=O)cc(Cl)c1O	C8H7ClO3	unknown
+O=Cc1cc2c(cc1Cl)OCO2	C8H5ClO3	unknown
+O=Cc1cc(Cl)c(O)cc1O	C7H5ClO3	unknown
+COc1cccc(OC)c1CC(C)=O	C11H14O3	unknown
+COc1cc(CC(C)=O)cc(OC)c1	C11H14O3	unknown
+COc1cc(CC(C)NC(=O)C(F)(F)F)c(OC)cc1I	C13H15F3INO3	unknown
+COc1cc(CC(C)N2C(=O)c3ccccc3C2=O)c(OC)cc1I	C19H18INO4	unknown
+COc1cc(CC(C)NC(=O)OC(C)(C)C)c(OC)cc1I	C16H24INO4	unknown
+c1ccc(CCNC2CCCCC2)cc1	C14H21N	unknown
+CCCCC(CC)NCCc1ccccc1	C15H25N	unknown
+CC1CCC(=O)N1CCc1ccccc1	C13H17NO	unknown
+CC(N)C(Cl)c1ccccc1	C9H12ClN	unknown
+CNC(C)C(c1ccccc1)C(c1ccccc1)C(C)NC	C20H28N2	unknown
+C=CCNC(C)Cc1ccccc1	C12H17N	unknown
+ClCc1ccccc1	C7H7Cl	unknown
+CC(Br)Cc1ccccc1	C9H11Br	unknown
+Cc1ccc(NCCc2ccccc2)cc1	C15H17N	unknown
+FC(F)(F)c1cccc(CCNc2ccccc2)c1	C15H14F3N	unknown
+Cc1ccc(CCNc2cccc(F)c2)cc1	C15H16FN	unknown
+CC(Cc1ccccc1)N1CCCCC1	C14H21N	unknown
+CC(Cc1ccccc1)N1CCOCC1	C13H19NO	unknown
+CC(Cc1ccccc1)N1CCN(C)CC1	C14H22N2	unknown
+CCC(Cc1ccccc1)N1CCCCC1	C15H23N	unknown
+CCCC(CN1CCCC1)c1ccccc1	C15H23N	unknown
+CCCCC(Cc1ccccc1)N1CCCC1	C16H25N	unknown
+CCCCC(Cc1ccccc1)N1CCCCC1	C17H27N	unknown
+CCCCC(CN1CCCCC1)c1ccccc1	C17H27N	unknown
+CCCCC(Cc1ccccc1F)N1CCCCC1	C17H26FN	unknown
+CCCCC(CN1CCCCC1)c1ccccc1F	C17H26FN	unknown
+c1ccc(CCN2CCOCC2)cc1	C12H17NO	unknown
+c1ccc(CCC(Cc2ccccc2)N2CCOCC2)cc1	C20H25NO	unknown
+c1ccc(CCNc2ccccc2)cc1	C14H15N	unknown
+c1ccc(CCN(CCc2ccccc2)c2ccccc2)cc1	C22H23N	unknown
+CC(Cc1ccccc1)C(N)c1ccccc1	C16H19N	unknown
+NC(CCc1ccccc1)c1ccccc1	C15H17N	unknown
+c1ccc(CCNC(CCc2ccccc2)c2ccccc2)cc1	C23H25N	unknown
+c1ccc(CNC2CCc3ccccc3C2)cc1	C17H19N	unknown
+NC(c1ccccc1)C1CCc2ccccc2C1	C17H19N	unknown
+CC(CN1CCCCC1)c1ccccc1	C14H21N	unknown
+c1ccc2c(c1)CCC(N1CCCCC1)C2	C15H21N	unknown
+c1ccc2c(c1)OCO2	C7H6O2	unknown
+c1ccc2c(c1)OCCO2	C8H8O2	unknown
+Oc1ccc2c(c1)OCO2	C7H6O3	unknown
+c1cc2c(cc1CC1CO1)OCO2	C10H10O3	unknown
+O=C(O)/C=C/C=C/c1ccc2c(c1)OCO2	C12H10O4	unknown
+O=C(O)c1ccc2c(c1)OCO2	C8H6O4	unknown
+C=CCc1ccc(O)c(O)c1	C9H10O2	unknown
+CC(O)C(O)c1ccc2c(c1)OCO2	C10H12O4	unknown
+CCCC(C)C1(CC)C(=O)NC(=O)NC1=O	C11H18N2O3	unknown
+COc1cc(CCNCc2cccc3c2OCCC3)c(OC)cc1C#N	C21H24N2O3	unknown
+COc1cc(CCNCc2cccc3c2OCC3)c(OC)cc1C#N	C20H22N2O3	unknown
+COc1cc(CCNCc2cccc(C)c2O)c(OC)cc1C#N	C19H22N2O3	unknown
+COc1cc(CCNCc2cccc3ccoc23)c(OC)cc1C#N	C20H20N2O3	unknown
+COc1cc(CCNCc2cccc(OC)c2O)c(OC)cc1C#N	C19H22N2O4	unknown
+CCc1cccc(CNCCc2cc(OC)c(C#N)cc2OC)c1O	C20H24N2O3	unknown
+C/C(=C\c1cc2ccccc2s1)[N+](=O)[O-]	C11H9NO2S	unknown
+C/C(=C\c1csc2ccccc12)[N+](=O)[O-]	C11H9NO2S	unknown
+C/C(=C\c1ccc2sccc2c1)[N+](=O)[O-]	C11H9NO2S	unknown
+C/C(=C\c1ccc2ccsc2c1)[N+](=O)[O-]	C11H9NO2S	unknown
+CC(=O)Cc1cccc2sccc12	C11H10OS	unknown
+CC(=O)Cc1cccc2ccsc12	C11H10OS	unknown
+COc1cc(CCN)ccc1Br	C9H12BrNO	unknown
+COc1cc(/C=C/[N+](=O)[O-])ccc1Br	C9H8BrNO3	unknown
+COc1cc(Br)ccc1/C=C/[N+](=O)[O-]	C9H8BrNO3	unknown
+COc1cc(Br)ccc1/C=C(\C)[N+](=O)[O-]	C10H10BrNO3	unknown
+O=c1oc2ccccc2c(O)c1[C@@H]1C[C@@H](c2ccc(-c3ccc(Br)cc3)cc2)Cc2ccccc21	C31H23BrO3	cannabinoid
+CN(C(=O)n1cnc(-c2ccc[n+]([O-])c2)c1)C1CCCCC1	C16H20N4O2	cannabinoid
+COC(=O)[C@@H](NC(C)=O)C(C)(C)C	C9H17NO3	unknown
+CC(C)(C)[C@H](NC(=O)c1cn(CCCCCF)c2ncccc12)C(=O)O	C19H26FN3O3	cannabinoid
+CC(C)(CO)[C@H](NC(=O)c1cn(CCCCCF)c2ncccc12)C(=O)O	C19H26FN3O4	cannabinoid
+CC(C)(NC(=O)c1cn(CCCCC(=O)O)c2ncccc12)c1ccccc1	C22H25N3O3	cannabinoid
+CCCC(C(=O)c1ccc(F)c(C)c1)N1CCCC1	C16H22FNO	beta-ketone
+CCCCC(C(O)c1ccccc1)N1CCCC1	C16H25NO	unknown
+CC(C)(c1ccccc1)n1ccc2[nH]c3ccccc3c2c1=O	C20H18N2O	cannabinoid
+CCCCCn1c2ccccc2c2c(=O)[nH]ccc21	C16H18N2O	cannabinoid
+O=C(c1ccc2[nH]c3ccccc3c2c1)c1cccc2ccccc12	C23H15NO	cannabinoid
+CC(O)CCCn1c2ccccc2c2cc(C(=O)c3cccc4ccccc34)ccc21	C28H25NO2	cannabinoid
+O=C(c1ccc2c(c1)c1ccccc1n2CCCCCO)c1cccc2ccccc12	C28H25NO2	cannabinoid
+CCCCCn1ccc2ncccc21	C12H16N2	unknown
+CCCCCn1ccc2cnccc21	C12H16N2	unknown
+CCCCCn1ccc2ccncc21	C12H16N2	unknown
+CCCCCn1ccc2cccnc21	C12H16N2	unknown
+CCCCCn1cc(C(=O)C(F)(F)F)c2ncccc21	C14H15F3N2O	unknown
+CCCCCn1cc(C(=O)C(F)(F)F)c2cnccc21	C14H15F3N2O	unknown
+CCCCCn1cc(C(=O)C(F)(F)F)c2ccncc21	C14H15F3N2O	unknown
+CCCCCn1cc(C(=O)C(F)(F)F)c2cccnc21	C14H15F3N2O	unknown
+CCCCCn1cc(C(=O)O)c2ncccc21	C13H16N2O2	unknown
+CCCCCn1cc(C(=O)O)c2cnccc21	C13H16N2O2	unknown
+CCCCCn1cc(C(=O)O)c2ccncc21	C13H16N2O2	unknown
+CCCCCn1cc(C(=O)O)c2cccnc21	C13H16N2O2	unknown
+CCCCCn1cc(C(=O)OC23CC4CC(CC(C4)C2)C3)c2ncccc21	C23H30N2O2	cannabinoid
+CCCCCn1cc(C(=O)OC23CC4CC(CC(C4)C2)C3)c2cnccc21	C23H30N2O2	cannabinoid
+CCCCCn1cc(C(=O)OC23CC4CC(CC(C4)C2)C3)c2ccncc21	C23H30N2O2	cannabinoid
+CCCCCn1cc(C(=O)OC23CC4CC(CC(C4)C2)C3)c2cccnc21	C23H30N2O2	cannabinoid
+CCCCCn1cc(C(=O)NC23CC4CC(CC(C4)C2)C3)c2ncccc21	C23H31N3O	cannabinoid
+CCCCCn1cc(C(=O)NC23CC4CC(CC(C4)C2)C3)c2cnccc21	C23H31N3O	cannabinoid
+CCCCCn1cc(C(=O)NC23CC4CC(CC(C4)C2)C3)c2ccncc21	C23H31N3O	cannabinoid
+CCCCCn1cc(C(=O)NC23CC4CC(CC(C4)C2)C3)c2cccnc21	C23H31N3O	cannabinoid
+CCCCCn1cc(C(=O)OC23CC4CC(CC(C4)C2)C3)c2ccccc21	C24H31NO2	cannabinoid
+CCCn1c(C)c(C(=O)c2cccc3ccc(OC)cc23)c2ccccc21	C24H23NO2	cannabinoid
+CCCn1cc(C(=O)c2cccc3ccc(OC)cc23)c2ccccc21	C23H21NO2	cannabinoid
+CCCCCn1c2ccc(C(=O)N3CCCCC3)cc2c2ccc(OC)cc21	C24H30N2O2	cannabinoid
+CCCCCn1c2ccccc2c2cc(C(=O)NCCc3ccc(Cl)cc3)ccc21	C26H27ClN2O	cannabinoid
+CC(=O)Oc1cccc2[nH]cc(C(=O)C(=O)N(C)C)c12	C14H14N2O4	tryptamine
+C[N+](C)(CCc1c[nH]c2cccc(OP(=O)([O-])OCc3ccccc3)c12)Cc1ccccc1	C26H29N2O4P	tryptamine
+CC(=O)Oc1cccc2[nH]cc(C(=O)C(=O)Cl)c12	C12H8ClNO4	unknown
+CN(C)CC(O)c1c[nH]c2cccc(O)c12	C12H16N2O2	tryptamine
+CN(C)C/C=C1\C=Nc2cccc(O)c21	C12H14N2O	unknown
+CC(C)(C)[C@H](NC(=O)c1nn(Cc2ccc(Cl)cc2Cl)c2ccccc12)C(=O)O	C21H21Cl2N3O3	cannabinoid
+CC(C)[C@H](NC(=O)c1nn(Cc2ccc(Cl)cc2Cl)c2ccccc12)C(=O)O	C20H19Cl2N3O3	cannabinoid
+CC(C)C[C@H](NC(=O)c1nn(Cc2ccc(Cl)cc2Cl)c2ccccc12)C(=O)O	C21H21Cl2N3O3	cannabinoid
+CNC(=O)[C@@H](NC(=O)c1nn(Cc2ccc(Cl)cc2Cl)c2ccccc12)C(C)C	C21H22Cl2N4O2	cannabinoid
+CNC(=O)[C@H](CC(C)C)NC(=O)c1nn(Cc2ccc(Cl)cc2Cl)c2ccccc12	C22H24Cl2N4O2	cannabinoid
+CNC(C)C(=O)c1ccc(O)c(O)c1	C10H13NO3	beta-ketone
+c1ccc2occc2c1	C8H6O	unknown
+c1ccc2c(c1)CCO2	C8H8O	unknown
+COc1ccccc1C(=O)C(C)N(C)OC	C12H17NO3	beta-ketone
+N#Cc1ccc(NC(=O)Nc2cccc(-c3nccc(N4CCCC4)n3)c2)cc1	C22H20N6O	cannabinoid
+N#Cc1ccc(NC(=O)Nc2cccc(-c3ccnc(N4CCCC4)n3)c2)cc1	C22H20N6O	cannabinoid
+CN1CCN(C2(CNC(=O)c3ccc(Cl)c(Cl)c3)CCCCC2)CC1	C19H27Cl2N3O	unknown
+O=C(NCC1(N2CCCCC2)CCCCC1)c1ccccc1Cl	C19H27ClN2O	unknown
+CN1CCN(C2(CNC(=O)c3ccccc3)CCCCC2)CC1	C19H29N3O	unknown
+CN(C(=O)c1ccc(Br)cc1Cl)[C@H]1CCCCC12CCCN2C	C18H24BrClN2O	unknown
+CC(C)(C)[C@H](NC(=O)c1ccc2[nH]c3ccccc3c2c1)C(=O)O	C19H20N2O3	unknown
+CCC(=O)N1C(C)CN(C/C=C/c2ccccc2)CC1C	C18H26N2O	unknown
+CCN(CC)CCn1c(Cc2ccc(OC)cc2)nc2ccccc21	C21H27N3O	unknown
+CCOC(=O)[C@@H](NC(=O)c1cn(CCCCCF)c2ccccc12)C(C)(C)C	C22H31FN2O3	cannabinoid
+COC(=O)[C@@H](NC(=O)c1cn(CCCCF)c2ccccc12)C(C)(C)C	C20H27FN2O3	cannabinoid
+CCN(CC)CCn1c(Cc2ccc(F)cc2)nc2cc([N+](=O)[O-])ccc21	C20H23FN4O2	unknown
+CN(C)CCc1c[nH]c2ccc(I)cc12	C12H15IN2	tryptamine
+CCOc1cc(SCC)c(OCC)cc1/C=C/[N+](=O)[O-]	C14H19NO4S	unknown
+CCOc1cc(SC)c(OC)cc1/C=C/[N+](=O)[O-]	C12H15NO4S	unknown
+COc1cc(SC(C)C)c(OC)cc1/C=C/[N+](=O)[O-]	C13H17NO4S	unknown
+CCCOc1ccc(/C=C/[N+](=O)[O-])cc1OC	C12H15NO4	unknown
+COc1cc(/C=C/[N+](=O)[O-])c(OC)cc1Cl	C10H10ClNO4	unknown
+CCOc1cc(SCC)c(OCC)cc1C=O	C13H18O3S	unknown
+COc1cc(C=O)cc(I)c1OC	C9H9IO3	unknown
+COc1cc(C=O)cc(OC)c1OCc1ccccc1	C16H16O4	unknown
+CCOc1cc(C=O)c(OCC)cc1C	C12H16O3	unknown
+CCOc1cc(SC)c(OC)cc1C=O	C11H14O3S	unknown
+CCOc1cc(C=O)cc(OC)c1OCC	C12H16O4	unknown
+CCCCCCC(C)NC(=O)c1nn(CCCCC)c2ccccc12	C21H33N3O	cannabinoid
+CCCCCn1nc(C(=O)N2CCC(Cc3ccccc3)CC2)c2ccccc21	C25H31N3O	cannabinoid
+CCCCCn1cc(C(=O)c2ccc(CC)cc2)c2ccccc21	C22H25NO	cannabinoid
+COc1ccc(C(=O)c2cn(CC3CCCCC3)c3ccccc23)cc1	C23H25NO2	cannabinoid
+CCCCn1nc(C(=O)c2ccc(C)c3ccccc23)c2ccccc21	C23H22N2O	cannabinoid
+CCCCn1nc(C(=O)c2ccc(CC)c3ccccc23)c2ccccc21	C24H24N2O	cannabinoid
+COc1ccc(C(=O)c2nn(CCCCCF)c3ccccc23)c2ccccc12	C24H23FN2O2	cannabinoid
+Cc1ccc(C(=O)c2nn(CC3CCCCC3)c3ccccc23)c2ccccc12	C26H26N2O	cannabinoid
+CCCCn1nc(C(=O)c2ccc(OC)c3ccccc23)c2ccccc21	C23H22N2O2	cannabinoid
+COc1ccc(C(=O)c2nn(CC3CCCCC3)c3ccccc23)c2ccccc12	C26H26N2O2	cannabinoid
+CCc1ccc(C(=O)c2nn(CC3CCCCC3)c3ccccc23)c2ccccc12	C27H28N2O	cannabinoid
+CCc1ccc(C(=O)c2nn(CC3CCOCC3)c3ccccc23)c2ccccc12	C26H26N2O2	cannabinoid
+COc1ccc(C(=O)c2nn(CC3CCOCC3)c3ccccc23)c2ccccc12	C25H24N2O3	cannabinoid
+CCCCCC(C)NC(=O)c1nn(CCCCCF)c2ccccc12	C20H30FN3O	cannabinoid
+CCCCCC(C)NC(=O)c1nn(CC2CCCCC2)c2ccccc12	C22H33N3O	cannabinoid
+O=C(NC1CCCCCC1)c1nn(CC2CCCCC2)c2ccccc12	C22H31N3O	cannabinoid
+O=C(NCc1ccccc1)c1nn(CCCCCF)c2ccccc12	C20H22FN3O	cannabinoid
+O=C(NCc1ccccc1)c1nn(CC2CCCCC2)c2ccccc12	C22H25N3O	cannabinoid
+CC(C)(C)c1cc(C(=O)c2cn(CCCCCF)c3ccccc23)on1	C21H25FN2O2	cannabinoid
+CC(C)(C)c1cc(C(=O)c2cn(CC3CCCCC3)c3ccccc23)on1	C23H28N2O2	cannabinoid
+CCCCCn1nc(C(=O)NC(C)C)c2ccccc21	C16H23N3O	cannabinoid
+CCCCCn1nc(C(=O)NCC2CCc3cc(OC)ccc32)c2ccccc21	C24H29N3O2	cannabinoid
+CCCNC(=O)c1cn(CCCCCF)c2ccccc12	C17H23FN2O	cannabinoid
+CC(C)NC(=O)c1cn(CCCCCF)c2ccccc12	C17H23FN2O	cannabinoid
+CCCCCNC(=O)c1cn(CCCCCF)c2ccccc12	C19H27FN2O	cannabinoid
+CCC(C)CC(C)NC(=O)c1cn(CCCCCF)c2ccccc12	C21H31FN2O	cannabinoid
+CCCCCC(C)NC(=O)c1cn(CCCCCF)c2ccccc12	C21H31FN2O	cannabinoid
+CCCCCCCNC(=O)c1cn(CCCCCF)c2ccccc12	C21H31FN2O	cannabinoid
+CCCCCCC(C)NC(=O)c1cn(CCCCCF)c2ccccc12	C22H33FN2O	cannabinoid
+O=C(NC1CCCCC1)c1cn(CCCCCF)c2ccccc12	C20H27FN2O	cannabinoid
+O=C(NC1CCCCCC1)c1cn(CCCCCF)c2ccccc12	C21H29FN2O	cannabinoid
+O=C(NCc1ccc(Cl)c(Cl)c1)c1cn(CCCCCF)c2ccccc12	C21H21Cl2FN2O	cannabinoid
+O=C(c1cn(CCCCCF)c2ccccc12)N1CCCc2ccccc21	C23H25FN2O	cannabinoid
+O=C(c1cn(CCCCCF)c2ccccc12)N1CCC(Cc2ccccc2)CC1	C26H31FN2O	cannabinoid
+Cc1ccccc1NC(=O)c1cn(CCCCCF)c2ccccc12	C21H23FN2O	cannabinoid
+Cc1cc(O)ccc1NC(=O)c1cn(CCCCCF)c2ccccc12	C21H23FN2O2	cannabinoid
+CNC(=O)[C@@H](NC(=O)c1cn(CC2CCCCC2)c2ccccc12)C(C)(C)C	C23H33N3O2	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1cn(CC2CCCCC2)c2ccccc12)C(=O)NC1CC1	C25H35N3O2	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1cn(CC2CCCCC2)c2ccccc12)C(=O)NCCO	C24H35N3O3	cannabinoid
+CC(C)(NC(=O)c1nn(CC(=O)NC2CCCCC2)c2ccccc12)c1ccccc1	C25H30N4O2	cannabinoid
+CC(C)(C)NC(=O)Cn1nc(C(=O)NC(C)(C)c2ccccc2)c2ccccc21	C23H28N4O2	cannabinoid
+CCCNC(=O)c1cn(CC2CCCCC2)c2ccccc12	C19H26N2O	cannabinoid
+CC(C)NC(=O)c1cn(CC2CCCCC2)c2ccccc12	C19H26N2O	cannabinoid
+CCCCCNC(=O)c1cn(CC2CCCCC2)c2ccccc12	C21H30N2O	cannabinoid
+CCC(C)CC(C)NC(=O)c1cn(CC2CCCCC2)c2ccccc12	C23H34N2O	cannabinoid
+CCCCCC(C)NC(=O)c1cn(CC2CCCCC2)c2ccccc12	C23H34N2O	cannabinoid
+CCCCCCCNC(=O)c1cn(CC2CCCCC2)c2ccccc12	C23H34N2O	cannabinoid
+CCCCCCC(C)NC(=O)c1cn(CC2CCCCC2)c2ccccc12	C24H36N2O	cannabinoid
+O=C(NC1CCCCC1)c1cn(CC2CCCCC2)c2ccccc12	C22H30N2O	cannabinoid
+O=C(NC1CCCCCC1)c1cn(CC2CCCCC2)c2ccccc12	C23H32N2O	cannabinoid
+O=C(NC1C2CC3CC(C2)CC1C3)c1cn(CC2CCCCC2)c2ccccc12	C26H34N2O	cannabinoid
+O=C(NCc1ccc(F)cc1)c1cn(CC2CCCCC2)c2ccccc12	C23H25FN2O	cannabinoid
+O=C(NCc1ccc(Cl)c(Cl)c1)c1cn(CC2CCCCC2)c2ccccc12	C23H24Cl2N2O	cannabinoid
+O=C(c1cn(CC2CCCCC2)c2ccccc12)N1CCCc2ccccc21	C25H28N2O	cannabinoid
+O=C(c1cn(CC2CCCCC2)c2ccccc12)N1CCC(Cc2ccccc2)CC1	C28H34N2O	cannabinoid
+COc1ccc2c(c1)CCC2CNC(=O)c1cn(CC2CCCCC2)c2ccccc12	C27H32N2O2	cannabinoid
+Cc1ccccc1NC(=O)c1cn(CC2CCCCC2)c2ccccc12	C23H26N2O	cannabinoid
+Cc1cccc(C)c1NC(=O)c1cn(CC2CCCCC2)c2ccccc12	C24H28N2O	cannabinoid
+O=C(Nc1cccc(Cl)c1Cl)c1cn(CC2CCCCC2)c2ccccc12	C22H22Cl2N2O	cannabinoid
+CCN(CC)C(=O)c1cn(CC2CCCCC2)c2ccccc12	C20H28N2O	cannabinoid
+CCCCCn1cc(C(=O)NCCC)c2ccccc21	C17H24N2O	cannabinoid
+CCCCCNC(=O)c1cn(CCCCC)c2ccccc12	C19H28N2O	cannabinoid
+CCCCCCCNC(=O)c1cn(CCCCC)c2ccccc12	C21H32N2O	cannabinoid
+CCCCCn1cc(C(=O)NC2CCCCCC2)c2ccccc21	C21H30N2O	cannabinoid
+CCCCCn1cc(C(=O)NCc2ccc(Cl)c(Cl)c2)c2ccccc21	C21H22Cl2N2O	cannabinoid
+CCCCCn1cc(C(=O)NCC2CCC3CC2C3(C)C)c2ccccc21	C24H34N2O	cannabinoid
+CC1(C)C2CCC(CNC(=O)c3cn(CCCCCF)c4ccccc34)C1C2	C24H33FN2O	cannabinoid
+CC1(C)C2CCC(CNC(=O)c3nn(CCCCCF)c4ccccc34)C1C2	C23H32FN3O	cannabinoid
+CC1(C)C2CCC(CNC(=O)c3cn(CC4CCCCC4)c4ccccc34)C1C2	C26H36N2O	cannabinoid
+CC1(C)C2CCC(CNC(=O)c3nn(CC4CCCCC4)c4ccccc34)C1C2	C25H35N3O	cannabinoid
+CCCCCn1cc(C(=O)NC(C)(C)c2ccc(Cl)cc2)c2ccccc21	C23H27ClN2O	cannabinoid
+CC(C)(NC(=O)c1cn(CCCCCF)c2ccccc12)c1ccc(Cl)cc1	C23H26ClFN2O	cannabinoid
+CC(C)(NC(=O)c1cn(CC2CCCCC2)c2ccccc12)c1ccc(Cl)cc1	C25H29ClN2O	cannabinoid
+CC(C)(NC(=O)c1nn(CC2CCCCC2)c2ccccc12)c1ccc(Cl)cc1	C24H28ClN3O	cannabinoid
+CCCCCn1nc(C(=O)NC2(c3ccccc3)CC2)c2ccccc21	C22H25N3O	cannabinoid
+CCCCCn1cc(C(=O)NC2(c3ccccc3)CC2)c2ccccc21	C23H26N2O	cannabinoid
+O=C(NC1(c2ccccc2)CC1)c1nn(CC2CCCCC2)c2ccccc12	C24H27N3O	cannabinoid
+CCCCCn1cc(C(=O)NC(C)(C)c2ccccc2)c2cc(F)ccc21	C23H27FN2O	cannabinoid
+CCCCCn1cc(C(=O)NC2CCCCC2)c2cc(F)ccc21	C20H27FN2O	cannabinoid
+CCCCCn1cc(C(=O)NC2CCCCCC2)c2cc(F)ccc21	C21H29FN2O	cannabinoid
+CCCCCn1cc(C(=O)NC2C3CC4CC(C3)CC2C4)c2cc(F)ccc21	C24H31FN2O	cannabinoid
+CCCCCn1cc(C(=O)NCc2ccccc2)c2cc(F)ccc21	C21H23FN2O	cannabinoid
+CCCCCn1cc(C(=O)NCc2ccc(F)cc2)c2cc(F)ccc21	C21H22F2N2O	cannabinoid
+CCCCCn1cc(C(=O)NCc2ccc(Cl)c(Cl)c2)c2cc(F)ccc21	C21H21Cl2FN2O	cannabinoid
+CCCCCn1cc(C(=O)NCC2CCC3CC2C3(C)C)c2cc(F)ccc21	C24H33FN2O	cannabinoid
+CCCCCn1cc(C(=O)NC(C)(C)c2ccc(Cl)cc2)c2cc(F)ccc21	C23H26ClFN2O	cannabinoid
+CCCCCn1cc(C(=O)NC2(c3ccccc3)CC2)c2cc(F)ccc21	C23H25FN2O	cannabinoid
+CCCCCn1cc(C(=O)NC2CCCCC2)c2ccc(F)cc21	C20H27FN2O	cannabinoid
+CCCCCn1cc(C(=O)NC2CCCCCC2)c2ccc(F)cc21	C21H29FN2O	cannabinoid
+CCCCCn1cc(C(=O)NCc2ccccc2)c2ccc(F)cc21	C21H23FN2O	cannabinoid
+CCCCCn1cc(C(=O)NCc2ccc(F)cc2)c2ccc(F)cc21	C21H22F2N2O	cannabinoid
+CCCCCn1cc(C(=O)NCc2ccc(Cl)c(Cl)c2)c2ccc(F)cc21	C21H21Cl2FN2O	cannabinoid
+CCCCCn1cc(C(=O)NCC2CCC3CC2C3(C)C)c2ccc(F)cc21	C24H33FN2O	cannabinoid
+CCCCCn1cc(C(=O)NC(C)(C)c2ccc(Cl)cc2)c2ccc(F)cc21	C23H26ClFN2O	cannabinoid
+CCCCCn1cc(C(=O)NC2(c3ccccc3)CC2)c2ccc(F)cc21	C23H25FN2O	cannabinoid
+O=C(NC1CCCCC1)c1cn(CC2CCOCC2)c2ccccc12	C21H28N2O2	cannabinoid
+O=C(NC1CCCCC1)c1nn(CC2CCOCC2)c2ccccc12	C20H27N3O2	cannabinoid
+O=C(NC1CCCCCC1)c1cn(CC2CCOCC2)c2ccccc12	C22H30N2O2	cannabinoid
+O=C(NC1CCCCCC1)c1nn(CC2CCOCC2)c2ccccc12	C21H29N3O2	cannabinoid
+O=C(NC1C2CC3CC(C2)CC1C3)c1cn(CC2CCOCC2)c2ccccc12	C25H32N2O2	cannabinoid
+O=C(NCc1ccccc1)c1cn(CC2CCOCC2)c2ccccc12	C22H24N2O2	cannabinoid
+O=C(NCc1ccccc1)c1nn(CC2CCOCC2)c2ccccc12	C21H23N3O2	cannabinoid
+O=C(NCc1ccc(F)cc1)c1nn(CC2CCOCC2)c2ccccc12	C21H22FN3O2	cannabinoid
+O=C(NCc1ccc(Cl)c(Cl)c1)c1cn(CC2CCOCC2)c2ccccc12	C22H22Cl2N2O2	cannabinoid
+O=C(NCc1ccc(Cl)c(Cl)c1)c1nn(CC2CCOCC2)c2ccccc12	C21H21Cl2N3O2	cannabinoid
+O=C(c1cn(CC2CCOCC2)c2ccccc12)N1CCCc2ccccc21	C24H26N2O2	cannabinoid
+O=C(c1nn(CC2CCOCC2)c2ccccc12)N1CCCc2ccccc21	C23H25N3O2	cannabinoid
+CC1(C)C2CCC(CNC(=O)c3cn(CC4CCOCC4)c4ccccc34)C1C2	C25H34N2O2	cannabinoid
+CC1(C)C2CCC(CNC(=O)c3nn(CC4CCOCC4)c4ccccc34)C1C2	C24H33N3O2	cannabinoid
+CC(C)(NC(=O)c1cn(CC2CCOCC2)c2ccccc12)c1ccc(Cl)cc1	C24H27ClN2O2	cannabinoid
+CC(C)(NC(=O)c1nn(CC2CCOCC2)c2ccccc12)c1ccc(Cl)cc1	C23H26ClN3O2	cannabinoid
+O=C(NC1(c2ccccc2)CC1)c1cn(CC2CCOCC2)c2ccccc12	C24H26N2O2	cannabinoid
+O=C(NC1(c2ccccc2)CC1)c1nn(CC2CCOCC2)c2ccccc12	C23H25N3O2	cannabinoid
+CCCCCn1cc(C(=O)OC(C)(C)c2ccccc2)c2ccccc21	C23H27NO2	cannabinoid
+CC(C)(OC(=O)c1cn(CCCCCF)c2ccccc12)c1ccccc1	C23H26FNO2	cannabinoid
+CC(C)(OC(=O)c1cn(CC2CCCCC2)c2ccccc12)c1ccccc1	C25H29NO2	cannabinoid
+CC(C)(OC(=O)c1cn(CC2CCOCC2)c2ccccc12)c1ccccc1	C24H27NO3	cannabinoid
+CC(C)(OC(=O)c1nn(CC2CCCCC2)c2ccccc12)c1ccccc1	C24H28N2O2	cannabinoid
+CC(C)(OC(=O)c1nn(CC2CCOCC2)c2ccccc12)c1ccccc1	C23H26N2O3	cannabinoid
+CCCCCOC(=O)c1nn(CCCCC)c2ccccc12	C18H26N2O2	cannabinoid
+O=C(OCC1CCOCC1)c1nn(CC2CCOCC2)c2ccccc12	C20H26N2O4	cannabinoid
+CCCCCn1nc2ccccc2c1C(=O)NC(C)(C)c1ccccc1	C22H27N3O	cannabinoid
+CC(C)(NC(=O)c1c2ccccc2nn1CC1CCOCC1)c1ccccc1	C23H27N3O2	cannabinoid
+CCCCCn1nc(C(=O)N(C)C)c2ccccc21	C15H21N3O	cannabinoid
+CN(C)C(=O)c1nn(CC2CCOCC2)c2ccccc12	C16H21N3O2	cannabinoid
+CCCCCn1nc(C(=O)Nc2ccccc2)c2ccccc21	C19H21N3O	cannabinoid
+CCCCCn1nc(C(=O)N[C@@H](C)c2ccccc2)c2ccccc21	C21H25N3O	cannabinoid
+C[C@H](NC(=O)c1nn(CC2CCOCC2)c2ccccc12)c1ccccc1	C22H25N3O2	cannabinoid
+C[C@@H](NC(=O)c1nn(CC2CCOCC2)c2ccccc12)c1ccccc1	C22H25N3O2	cannabinoid
+C#CC(C)(C)NC(=O)c1cn(CCCCC)c2ccccc12	C19H24N2O	cannabinoid
+C#CC(C)(C)NC(=O)c1cn(CC2CCCCC2)c2ccccc12	C21H26N2O	cannabinoid
+C#CC(C)(C)NC(=O)c1cn(CCCCCF)c2ccccc12	C19H23FN2O	cannabinoid
+C#CC(C)(C)NC(=O)c1cn(CC2CCOCC2)c2ccccc12	C20H24N2O2	cannabinoid
+C#CC(C)(C)NC(=O)c1nn(CCCCC)c2ccccc12	C18H23N3O	cannabinoid
+C#CC(C)(C)NC(=O)c1nn(CC2CCOCC2)c2ccccc12	C19H23N3O2	cannabinoid
+CCCCCn1cc(C(=O)CC(C)(C)c2ccccc2)c2ccccc21	C24H29NO	cannabinoid
+CCCCCn1cc(C(=O)NC(C)(C)C#N)c2ccccc21	C18H23N3O	cannabinoid
+CCCCCn1cc(C(=O)NC(C)(C)CN2CCCC2)c2ccccc21	C22H33N3O	cannabinoid
+CCCCCn1nc(C(=O)NC(C)(C)C#N)c2ccccc21	C17H22N4O	cannabinoid
+CCCCCn1nc(C(=O)NC(C)(C)CN2CCCC2)c2ccccc21	C21H32N4O	cannabinoid
+CCCCCn1nc(C(=O)NC2(c3ccccc3)CCOCC2)c2ccccc21	C24H29N3O2	cannabinoid
+CC(C)(C#N)NC(=O)c1cn(CC2CCOCC2)c2ccccc12	C19H23N3O2	cannabinoid
+CC(C)(CN1CCCC1)NC(=O)c1cn(CC2CCOCC2)c2ccccc12	C23H33N3O2	cannabinoid
+O=C(NC1(c2ccccc2)CCOCC1)c1cn(CC2CCOCC2)c2ccccc12	C26H30N2O3	cannabinoid
+CCCCCn1nc(C(=O)NC2(c3ccccc3)CCCC2)c2ccccc21	C24H29N3O	cannabinoid
+O=C(NC1(c2ccccc2)CCCC1)c1cn(CC2CCOCC2)c2ccccc12	C26H30N2O2	cannabinoid
+CCCCCn1cc(C(=O)NC(C)(C)C(=O)OC)c2ccccc21	C19H26N2O3	cannabinoid
+COC(=O)C(C)(C)NC(=O)c1nn(CCCCCF)c2ccccc12	C18H24FN3O3	cannabinoid
+COC(=O)C(C)(C)NC(=O)c1nn(CC2CCOCC2)c2ccccc12	C19H25N3O4	cannabinoid
+CCCCCn1cc(C(=O)NC(C)(CC)c2ccccc2)c2ccccc21	C24H30N2O	cannabinoid
+CCC(C)(NC(=O)c1nn(CC2CCOCC2)c2ccccc12)c1ccccc1	C24H29N3O2	cannabinoid
+CC(C)(NC(=O)c1nn(CC2CCOCC2)c2cccc(Cl)c12)c1ccccc1	C23H26ClN3O2	cannabinoid
+CC(C)(NC(=O)c1nn(CC2CCOCC2)c2ccc(Cl)cc12)c1ccccc1	C23H26ClN3O2	cannabinoid
+CC(C)(CC(=O)c1nn(CC2CCOCC2)c2cc(Cl)ccc12)c1ccccc1	C24H27ClN2O2	cannabinoid
+CC(C)(NC(=O)c1nn(CC2CCOCC2)c2c(Cl)cccc12)c1ccccc1	C23H26ClN3O2	cannabinoid
+Oc1cccc([C@]23CCC[C@H]([C@H]2O)N(CCc2ccccc2)CC3)c1	C22H27NO2	unknown
+C=CC(=O)N(c1ccn(-c2ccccc2)n1)C1CCN(CCc2ccccc2)CC1	C25H28N4O	unknown
+C[C@H]1[C@@H]2CC[C@@H](c3ccccc3)CN2CC[C@@]1(C)c1cccc(O)c1	C23H29NO	unknown
+CCC(=O)N(CC1CCCCN1Cc1ccc2c(c1)CCC[C@@H]2O)c1ccccc1	C26H34N2O2	unknown
+CCOc1ccc(Cc2nc3ccccc3n2CCN(CC)CC)cc1	C22H29N3O	unknown
+CCOc1ccc(Cc2nc3ccccc3n2CCN2CCCCC2)cc1	C23H29N3O	prophetic
+CCOc1ccc(Cc2nc3cc(N)ccc3n2CCN(CC)CC)cc1	C22H30N4O	unknown
+CCc1ccc(Cc2nc3cc([N+](=O)[O-])ccc3n2CCN(CC)CC)cc1	C22H28N4O2	unknown
+CCC(=O)N(c1ccccn1)C(C)CN1CCCC(C)(C)C1	C18H29N3O	unknown
+CCC(=O)N(c1ccccn1)C(C)CN1CCC(c2ccccc2)CC1	C22H29N3O	unknown
+CCC(=O)N(CC1(N2CCN(Cc3ccccc3)CC2)CCOCC1)c1ccccc1	C26H35N3O2	unknown
+CN(C)CCc1c[nH]c2cccc(OP(=O)(Cl)Cl)c12	C12H15Cl2N2O2P	tryptamine
+CN(C)CCc1c[nH]c2cccc(OP(=O)(O)Cl)c12	C12H16ClN2O3P	tryptamine
+CN(C)CCc1c[nH]c2cccc(OP(=O)(Cl)OP(=O)(Cl)Cl)c12	C12H15Cl3N2O4P2	tryptamine
+CN(C)CCc1c[nH]c2cccc(OP(=O)(O)OP(=O)(O)O)c12	C12H18N2O7P2	tryptamine
+Cc1ccc(C(=O)N[C@@H]2C(C)(C)[C@@H]3CC[C@@]2(C)C3)cc1S(=O)(=O)N1CCOCC1	C22H32N2O4S	cannabinoid
+Cc1ccc(C(=O)C(=O)[C@@H]2C(C)(C)[C@@H]3CC[C@@]2(C)C3)cc1S(=O)(=O)N1CCOCC1	C23H31NO5S	cannabinoid
+O=C(Oc1cccc2cccnc12)c1cccc(S(=O)(=O)N2CCOCC2)c1	C20H18N2O5S	cannabinoid
+Cc1ccc(-c2nnn(CC(C)(C)C)n2)cc1S(=O)(=O)N1CCOCC1	C17H25N5O3S	cannabinoid
+COc1ccc(F)c(-c2nc(-c3cccc(CN4CCCCC4)c3)c[nH]2)c1	C22H24FN3O	cannabinoid
+COc1ccc(F)c(-c2nc(-c3cccc(CN4CCC(F)(F)CC4)c3)c[nH]2)c1	C22H22F3N3O	cannabinoid
+CCCCCOc1ccc(C(=O)Oc2cccc3cccnc23)c2ccccc12	C25H23NO3	cannabinoid
+CCc1cc(OC)c(CCN)cc1OC(C)C	C14H23NO2	unknown
+CC(=O)Oc1cccc2[nH]cc(CC[N+](C)(C)C)c12	C15H21N2O2	tryptamine
+CCNC1(c2cccc(C)c2)CCCCC1=O	C15H21NO	arylcycloalkylamine
+CC(C)N(C)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)C3CC3)C[C@H]2N(C)C1	C24H29N3O2	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C=O)C[C@H]2N(C)C1	C21H25N3O2	unknown
+COc1cc(CCN)cc(OC)c1OCC1CC1(F)F	C14H19F2NO3	unknown
+COc1cc(CCN)cc(OC)c1OCC(C)(F)F	C13H19F2NO3	unknown
+C=C(CC)COc1c(OC)cc(CCN)cc1OC	C15H23NO3	unknown
+COc1cc(SC)ccc1CCN	C10H15NOS	unknown
+N#Cc1c2c(c(CCN)c3c1OCC3)OCC2	C13H14N2O2	unknown
+CCNCCc1c2c(c(C)c3c1C(C)CC3)C(C)CC2	C19H29N	prophetic
+Cc1c2c(c(CCN(C)C)c3c1OCC3)OCC2	C15H21NO2	prophetic
+COc1ccccc1CNCCc1cnc2sccn2c1=O	C16H17N3O2S	prophetic
+COc1cscc1CNCCc1c2c(c(Cl)c3c1OCC3)OCC2	C18H20ClNO3S	prophetic
+COc1cc(OC)c(CCNCc2ccccc2OC)cc1Br	C18H22BrNO3	prophetic
+COc1ccccc1CNCC1CCc2c1cc(OC)c(OC)c2OC	C21H27NO4	prophetic
+COc1cc(CCNCc2ccc(F)cc2OC)c(OC)cc1I	C18H21FINO3	prophetic
+CCc1cc(OC)c(CCNCc2c(O)cccc2F)cc1OC	C19H24FNO3	prophetic
+COc1cc(C(CNCc2ccccc2OC)OC)c(OC)cc1C	C20H27NO4	prophetic
+COc1cc(CCN)c(OC)cc1CC#N	C12H16N2O2	prophetic
+CCSc1ccc(CCNCc2cscc2OC)c(OC)c1	C17H23NO2S2	prophetic
+COc1cc(SCCO)c(OC)cc1CCNCc1ccccc1OC	C20H27NO4S	prophetic
+COc1cc(CCNCc2ccccc2OC)c(OC)cc1CC#N	C20H24N2O3	prophetic
+COc1cc(CCNCc2cccc3c2OCC3)c(OC)cc1Cl	C19H22ClNO3	prophetic
+COc1cc2c(cc1CCNCc1ccccc1OC)OCO2	C18H21NO4	unknown
+COc1ccccc1CNCCc1cc(OC)c2c(c1OC)OCO2	C19H23NO5	prophetic
+COc1cc(CCNC2COc3ccccc32)c(OC)cc1Cl	C18H20ClNO3	prophetic
+NCCc1c2ccoc2c(Cl)c2ccoc12	C12H10ClNO2	unknown
+COc1cc(CCNCc2ccccc2SC)c(OC)cc1I	C18H22INO2S	prophetic
+COc1cc(CCNCC(=O)c2ccccc2)c(OC)cc1I	C18H20INO3	prophetic
+COc1cc(CCNCc2ccccc2S(C)=O)c(OC)cc1I	C18H22INO3S	prophetic
+COc1cc(CCNCc2ccccc2S(C)(=O)=O)c(OC)cc1I	C18H22INO4S	prophetic
+CCN(CC)C(=S)Oc1ccccc1CNCCc1cc(OC)c([N+](=O)[O-])cc1OC	C22H29N3O5S	prophetic
+CCOc1ccccc1CNCCc1cc(OC)c(I)cc1OC	C19H24INO3	prophetic
+COCCOc1ccccc1CNCCc1cc(OC)c(I)cc1OC	C20H26INO4	prophetic
+COc1cc(Cl)ccc1CCNCc1ccccc1OC	C17H20ClNO2	prophetic
+COc1c(CC(C)N)c(OC)c2ccoc2c1OC	C14H19NO4	prophetic
+COc1cc(CC(C)(C)N)c(OC)cc1Br	C12H18BrNO2	unknown
+COCc1cc(CC(C)N)cc(OC)c1OC	C13H21NO3	unknown
+COc1cc(CCN)ccc1C	C10H15NO	unknown
+COc1cc(C(C)CN)ccc1C	C11H17NO	unknown
+COc1ccc(C2CC3CCC2NC3)cc1OC	C15H21NO2	unknown
+COc1cc(C2CC3CCC2NC3)cc(OC)c1OC	C16H23NO3	unknown
+COC(=O)C(c1cc(OC)c(OC)c(OC)c1)C1CCCCN1	C17H25NO5	unknown
+C=CCCCn1cc(C(=O)N[C@H](C(=O)OC)C(C)(C)C)c2ccccc21	C21H28N2O3	cannabinoid
+CC(C)(NC(=O)c1cn(CC2CCC2)c2ccccc12)c1ccccc1	C23H26N2O	cannabinoid
+COc1ccc2[nH]ccc2c1	C9H9NO	unknown
+COc1ccc2[nH]cc(C(=O)C(=O)N(C)C)c2c1	C13H14N2O3	tryptamine
+COc1ccc2c(c1)/C(=C/CN(C)C)C=[NH+]2	C13H16N2O	unknown
+COc1ccc2[nH]cc(CC[N+](C)(C)CCl)c2c1	C14H20ClN2O	tryptamine
+COc1ccc2[nH]c(CCCCN(C)C)c(CCN(C)C)c2c1	C19H31N3O	tryptamine
+COc1ccc2c3c([nH]c2c1)CCN(C)CC3	C14H18N2O	unknown
+CC[C@H]1C[C@@H]2C[C@H]3c4[nH]c5cc(OC)c(OC)cc5c4CCN(C2)[C@@H]13	C21H28N2O2	unknown
+CSc1ccc2c(c1)C(N1CCN(C)CC1)Cc1ccccc1S2	C20H24N2S2	unknown
+CCOC(=O)c1ccc(N)cc1	C9H11NO2	unknown
+CCC(C)Sc1cc(OC)c(/C=C/[N+](=O)[O-])cc1OC	C14H19NO4S	unknown
+COc1cc(C(=O)Cl)cc(OC)c1OC	C10H11ClO4	unknown
+COc1cc(CCC(=O)O)cc(OC)c1OC	C12H16O5	unknown
+CCN(CC)CCn1c(Cc2ccccc2)nc2cc([N+](=O)[O-])ccc21	C20H24N4O2	unknown
+CCCCOc1ccc(Cc2nc3cc([N+](=O)[O-])ccc3n2CCN(CC)CC)cc1	C24H32N4O3	unknown
+CCN(CC)CCn1c(Cc2ccc(Br)cc2)nc2cc([N+](=O)[O-])ccc21	C20H23BrN4O2	unknown
+CCN(CC)CCn1c(Cc2ccc(C)cc2)nc2cc([N+](=O)[O-])ccc21	C21H26N4O2	unknown
+CCNCCn1c(Cc2ccc(OC(C)C)cc2)nc2cc([N+](=O)[O-])ccc21	C21H26N4O3	unknown
+CCN(CC)CCn1c(Cc2ccc(OC(C)C)cc2)nc2ccccc21	C23H31N3O	unknown
+CCCOc1ccc(Cc2nc3ccccc3n2CCN(CC)CC)cc1	C23H31N3O	unknown
+CCN(CC)CCn1c(Cc2ccc(C(C)(C)C)cc2)nc2cc([N+](=O)[O-])ccc21	C24H32N4O2	unknown
+CCN(CC)CCn1c(Cc2ccc(OC(C)=O)cc2)nc2cc([N+](=O)[O-])ccc21	C22H26N4O4	unknown
+CCN(CC)CCn1c(Cc2ccc(OC)c(OC)c2)nc2cc([N+](=O)[O-])ccc21	C22H28N4O4	unknown
+CCN(CC)CCn1c(Cc2ccc(SC)cc2)nc2cc([N+](=O)[O-])ccc21	C21H26N4O2S	unknown
+CCSc1ccc(Cc2nc3cc([N+](=O)[O-])ccc3n2CCN(CC)CC)cc1	C22H28N4O2S	unknown
+CCN(CC)CCn1c(C(C(N)=O)c2ccc(Cl)cc2)nc2cc([N+](=O)[O-])ccc21	C21H24ClN5O3	unknown
+CCN(CC)CCn1c(Cc2cccc(OC)c2)nc2cc([N+](=O)[O-])ccc21	C21H26N4O3	unknown
+CCN(CC)CCn1c(Cc2ccccc2)nc2ccccc21	C20H25N3	unknown
+CCN(CC)CCn1c(Cc2ccc(O)cc2)nc2cc([N+](=O)[O-])ccc21	C20H24N4O3	unknown
+CCN(CC)CCn1c(C(C)c2ccc(OC)cc2)nc2cc([N+](=O)[O-])ccc21	C22H28N4O3	unknown
+CCN(CC)CCn1c(CCc2ccc(OC)cc2)nc2cc([N+](=O)[O-])ccc21	C22H28N4O3	unknown
+CCOc1ccc(Cc2nc3cc([N+](=O)[O-])ccc3n2CCN2CCOCC2)cc1	C22H26N4O4	unknown
+CCOc1ccc(Cc2nc3ccc([N+](=O)[O-])cc3n2CCN(CC)CC)cc1	C22H28N4O3	unknown
+CCOc1ccc(Cc2nc3cc([N+](=O)[O-])ccc3n2CCN2CCCC2)cc1	C22H26N4O3	unknown
+CCOc1ccc(Cc2nc3cc([N+](=O)[O-])ccc3n2CCN(C)C)cc1	C20H24N4O3	unknown
+CCOc1ccc(Cc2nc3cc([N+](=O)[O-])ccc3n2CCN2CCCCC2)cc1	C23H28N4O3	unknown
+CCOc1ccc(Cc2nc3cc(C(C)=O)ccc3n2CCN(CC)CC)cc1	C24H31N3O2	unknown
+CCOc1ccc(Cc2nc3cc(OC)ccc3n2CCN(CC)CC)cc1	C23H31N3O2	unknown
+CCN(CC)CCn1c(Cc2ccc(OC)cc2)nc2ccc(Cl)cc21	C21H26ClN3O	unknown
+CCOc1ccc(Cc2nc3cc(Cl)c(Cl)cc3n2CCN(C)C)cc1	C20H23Cl2N3O	unknown
+CCOc1ccc(Oc2nc3ccccc3n2CCN(CC)CC)cc1	C21H27N3O2	unknown
+CCOc1ccc(Sc2nc3ccccc3n2CCN2CCCCC2)cc1	C22H27N3OS	unknown
+CCCCC(C(=O)c1cccc(F)c1)N1CCCC1	C16H22FNO	beta-ketone
+N#CCCCCn1nc(C(=O)NCc2ccccc2)c2ccccc21	C20H20N4O	cannabinoid
+C[N+](C)(C)CCOP(=O)(O)OP(=O)(O)OCC1OC(n2ccc(N)nc2=O)C(O)C1O	C14H26N4O11P2	unknown
+CC(C)(NC(=O)c1nn(CC2CCC2)c2ccccc12)c1ccccc1	C22H25N3O	cannabinoid
+COc1cccc2ccc(N3CCNCC3)nc12	C14H17N3O	unknown
+COc1cccc2ccc(N3CCN(C)CC3)nc12	C15H19N3O	unknown
+c1ccc2nc(N3CCCCC3)ccc2c1	C14H16N2	unknown
+COc1cccc2ccc(N3CCCCC3)nc12	C15H18N2O	unknown
+CCCN(CCC)c1ccc2ccccc2n1	C15H20N2	unknown
+CCCN(CCC)c1ccc2cccc(OC)c2n1	C16H22N2O	unknown
+Nc1ccc2ccccc2n1	C9H8N2	unknown
+COc1cccc2ccc(N)nc12	C10H10N2O	unknown
+Nc1cnc2ccccc2c1	C9H8N2	unknown
+c1ccc2cc(N3CCNCC3)ccc2c1	C14H16N2	unknown
+c1ccc2c(N3CCNCC3)nccc2c1	C13H15N3	unknown
+COc1cccc(N)c1C(=O)CCN	C10H14N2O2	unknown
+Oc1ccccc1N1CCNCC1	C10H14N2O	unknown
+O=C(c1cccc(Cl)c1)N1CCNCC1	C11H13ClN2O	unknown
+COc1cc(C)c(OC)c(C(=O)N2CCNCC2)c1	C14H20N2O3	unknown
+COc1cc(Br)c(OC)c(C(=O)N2CCNCC2)c1	C13H17BrN2O3	unknown
+CCC(C)C1(CC)C(=O)NC(=O)NC1=O	C10H16N2O3	unknown
+CCN1CCCC(OC(=O)C(O)(c2ccccc2)c2cccs2)C1	C19H23NO3S	unknown
+CN1CCN(CCCN2c3ccccc3Sc3ccc(Cl)cc32)CC1	C20H24ClN3S	unknown
+O=C(c1ccccc1)C(c1ccccc1)N1CCCC1	C18H19NO	beta-ketone
+CCNC(C)Cc1cccs1	C9H15NS	unknown
+CCC(C)N(CCc1c[nH]c2ccc(OC)cc12)C(C)CC	C19H30N2O	tryptamine
+C=CCN1C[C@H](C(=O)N(CC)CC)C=C2c3cccc4c3c(cn4C(=O)C3CC3)C[C@H]21	C26H31N3O2	unknown
+CCCc1ccc(Cc2nc3cc([N+](=O)[O-])ccc3n2CCN(CC)CC)cc1	C23H30N4O2	unknown
+CCOCCOc1ccc(Cc2nc3cc([N+](=O)[O-])ccc3n2CCN(CC)CC)cc1	C24H32N4O4	unknown
+CCOc1ccc(Sc2nc3ccccc3n2CCN2CCCC2)cc1	C21H25N3OS	unknown
+CCOc1ccc(Cc2nc3ccccc3n2CCN2CCCC2)cc1	C22H27N3O	unknown
+CCOc1ccc(Sc2nc3ccccc3n2CCN(CC)CC)cc1	C21H27N3OS	unknown
+CCN(C(=O)c1ccc(Cl)c(Cl)c1)[C@@H]1CCCC[C@H]1N(C)C	C17H24Cl2N2O	unknown
+CCCCC(NC)C(=O)c1ccc2c(c1)OCO2	C14H19NO3	beta-ketone
+CCCC(=O)N1CCN(C/C=C/c2ccc(C)cc2)CC1C	C19H28N2O	unknown
+Fc1ccc(N2CCNCC2)cc1Cl	C10H12ClFN2	unknown
+c1ccc([C@]2(CCNC3CCC4(SCCS4)c4ccccc43)CCOC3(CCCC3)C2)nc1	C28H36N2OS2	unknown
+CCC(=O)NCCC1CCc2ccc3c(c21)CCO3	C16H21NO2	unknown
+Brc1ccc(N2CCNCC2)cc1	C10H13BrN2	unknown
+CO[C@]12C=C[C@]34C[C@@]1(C)[C@H](c1ccccc1)N[C@H]2[C@@]31CCN(C)[C@@H]4Cc2ccc(O)cc21	C28H32N2O2	unknown
+CO[C@]12C=C[C@]34C[C@@]1(C)[C@@H](c1ccccc1)N[C@H]2[C@@]31CCN(C)[C@@H]4Cc2ccc(O)cc21	C28H32N2O2	unknown
+COc1cccc(CCNCc2ccccc2OC)c1	C17H21NO2	unknown
+CN1CCOC(c2ccccc2)c2ccccc2C1	C17H19NO	unknown
+Cc1ncsc1CCCl	C6H8ClNS	unknown
+c1ccc(C2CNCCO2)cc1	C10H13NO	unknown
+CC1NC(=O)COC1c1ccccc1	C11H13NO2	unknown
+CC(C)N1CCOC(c2ccccc2)C1	C13H19NO	unknown
+CCC(C(=O)OCCN1CCOC(c2ccccc2)C1C)c1ccccc1	C23H29NO3	unknown
+CC1NCCOC1c1ccc2ccccc2c1	C15H17NO	unknown
+CC1NCCOC1c1cccs1	C9H13NOS	unknown
+CC1N(C)CCOC1(O)c1ccccc1	C12H17NO2	unknown
+C[C@@H]1CO[C@@](O)(c2cc(F)cc(F)c2)[C@H](C)N1	C12H15F2NO2	unknown
+CCCN1CCO[C@H](c2cccc(O)c2)C1	C13H19NO2	unknown
+CCCN1C[C@@H](c2ccc(N)nc2)OC[C@@H]1C	C13H21N3O	unknown
+CCCN1CCC[C@@H](c2cccc(S(C)(=O)=O)c2)C1	C15H23NO2S	unknown
+CC1NCCSC1c1ccccc1	C11H15NS	unknown
+O=c1[nH]c2cc(Cl)c(Cl)cc2n1C1CCN(Cc2ccc(Cl)cc2)CC1	C19H18Cl3N3O	unknown
+Fc1cncc(CNCC[C@@]2(c3ccccn3)CCOC3(CCCC3)C2)c1	C22H28FN3O	unknown
+Cc1nnc(C(CCN2CC3CCC2CC3)(c2ccccc2)c2ccccc2)o1	C25H29N3O	unknown
+COc1cc(C)c(C=O)cc1OC	C10H12O3	unknown
+Cc1cccc(C#Cc2ccccc2)n1	C14H11N	unknown
+OC1(c2ccc(Cl)cc2)c2ccccc2C2=NCCCN21	C17H15ClN2O	unknown
+COC(=O)C(c1ccccc1)N1CCCC1	C13H17NO2	unknown
+CCSc1nc2ccccc2[nH]1	C9H10N2S	unknown
+CC(C)(C)[C@H](NC(=O)c1nn(CCc2ccccc2)c2ccccc12)C(N)=O	C22H26N4O2	cannabinoid
+C=CCCCn1nc(C(=O)N[C@H](C(N)=O)C(C)(C)C)c2ccccc21	C19H26N4O2	cannabinoid
+CC1N=C(N)OC1c1ccc(Cl)cc1	C10H11ClN2O	unknown
+CC1N=C(N)OC1c1ccc(Br)cc1	C10H11BrN2O	unknown
+CC(C)(N)C(=O)N[C@H](COCc1ccccc1)C(=O)N1CCC2(CC1)CN(S(C)(=O)=O)c1ccccc12	C27H36N4O5S	unknown
+O=C(O)c1c[nH]c2ccccc12	C9H7NO2	unknown
+O=C(O)CCCCn1cc(C(=O)O)c2ccccc21	C14H15NO4	unknown
+C#CC(O)(/C=C/Cl)CC	C7H9ClO	unknown
+OC1(c2ccc(Cl)cc2)c2ccccc2C2=NCCN21	C16H13ClN2O	unknown
+CCC(C)(C)OC(N)=O	C6H13NO2	unknown
+C#CC(O)(CC)CC	C7H12O	unknown
+NC(=O)C[S@@](=O)C(c1ccccc1)c1ccccc1	C15H15NO2S	unknown
+CN(N=O)C1=Nc2ccc(Cl)cc2C(c2ccccc2F)=NC1	C16H12ClFN4O	aryldiazepine
+OCc1nnc2n1-c1ccc(Cl)cc1C(c1ccccc1F)=NC2	C17H12ClFN4O	aryldiazepine
+Cc1nnc2n1-c1ccc(Cl)cc1C(c1ccccc1F)=NC2O	C17H12ClFN4O	aryldiazepine
+OCc1nnc2n1-c1ccc(Cl)cc1C(c1ccccc1F)=NC2O	C17H12ClFN4O2	aryldiazepine
+CCC1CC2CCC1N(CC)C2	C11H21N	unknown
+CCC1CC2CCC1N(CCc1c[nH]c3ccccc13)C2	C19H26N2	unknown
+CCC1CC2CCC1N(CCc1c[nH]c3ccc(OC)cc13)C2	C20H28N2O	unknown
+CCC1CC2CCC1N(CCc1c[nH]c3ccc(O)cc13)C2	C19H26N2O	unknown
+CN1CCc2[nH]c3ccccc3c2CC1	C13H16N2	unknown
+COc1ccc2[nH]c3c(c2c1)CCN(C)CC3	C14H18N2O	unknown
+CN1CCc2[nH]c3ccc(O)cc3c2CC1	C13H16N2O	unknown
+CN1CCc2[nH]c3ccc(F)cc3c2CC1	C13H15FN2	unknown
+CN1CCc2[nH]c3ccc(Cl)cc3c2CC1	C13H15ClN2	unknown
+CN1CCc2[nH]c3ccc(Br)cc3c2CC1	C13H15BrN2	unknown
+OCCc1c[nH]c2ccc(OCc3ccccc3)cc12	C17H17NO2	unknown
+O=S(=O)(O)ON(c1ccccc1)C1CCN(CCc2ccccc2)CC1	C19H24N2O4S	unknown
+O=C(C1=CC(O)C(O)O1)N(c1ccccc1)C1CCN(CCc2ccccc2)CC1	C24H28N2O4	fentanyl
+O=C(c1ccco1)N(c1ccccc1)C1CCN(CC(O)c2ccccc2)CC1	C24H26N2O3	fentanyl
+COc1cc(CCN2CCC(N(C(=O)c3ccco3)c3ccccc3)CC2)ccc1O	C25H28N2O4	fentanyl
+CCCCCCCC(C(=O)c1ccc(F)cc1)N1CCCC1	C19H28FNO	unknown
+CCCCCCCC(C(=O)c1ccc(OC)cc1)N1CCCC1	C20H31NO2	beta-ketone
+CCCCCCCC(C(=O)c1ccc2c(c1)OCO2)N1CCCC1	C20H29NO3	beta-ketone
+CCCNCc1ccccc1	C10H15N	unknown
+CCN(C)Cc1ccccc1	C10H15N	unknown
+CCNC(C)c1ccccc1	C10H15N	unknown
+CCCC(N)c1ccccc1	C10H15N	unknown
+CC(C)C(N)c1ccccc1	C10H15N	unknown
+NCCCCc1ccccc1	C10H15N	unknown
+O=C(CCCN1CCN(c2ccccn2)CC1)c1ccc(F)cc1	C19H22FN3O	unknown
+O=C1CN2CCOC2(c2ccccc2)c2cc(Cl)ccc2N1	C17H15ClN2O2	aryldiazepine
+CC(=O)Oc1cccc2[nH]cc(C(=O)C(=O)N(C)Cc3ccccc3)c12	C20H18N2O4	tryptamine
+CC(=O)Oc1cccc2[nH]cc(C(=O)C(=O)N(Cc3ccccc3)Cc3ccccc3)c12	C26H22N2O4	tryptamine
+CN(CCc1c[nH]c2cccc(O)c12)Cc1ccccc1	C18H20N2O	tryptamine
+CN(CCc1c[nH]c2cccc(OP3(=O)OCc4ccccc4CO3)c12)Cc1ccccc1	C26H27N2O4P	tryptamine
+O=P1(Oc2cccc3[nH]cc(CCN(Cc4ccccc4)Cc4ccccc4)c23)OCc2ccccc2CO1	C32H31N2O4P	tryptamine
+CC(=O)C(N)c1ccc(C)cc1C	C11H15NO	unknown
+CCC(=O)N(c1ccccc1)C1(C(=O)OC)CCN(CCC(=O)O)CC1	C19H26N2O5	fentanyl
+O=C(c1cccc2ccccc12)c1cn(Cc2ccccc2F)c2ccccc12	C26H18FNO	cannabinoid
+O=C(c1cccc2ccccc12)c1cn(Cc2cccc(F)c2)c2ccccc12	C26H18FNO	cannabinoid
+O=C(c1ccc2ccccc2c1)c1cn(Cc2ccccc2F)c2ccccc12	C26H18FNO	cannabinoid
+O=C(c1ccc2ccccc2c1)c1cn(Cc2cccc(F)c2)c2ccccc12	C26H18FNO	cannabinoid
+O=C(c1ccc2ccccc2c1)c1cn(Cc2ccc(F)cc2)c2ccccc12	C26H18FNO	cannabinoid
+O=C1CCC[C@@H]2[C@H]3CCCN4CCC[C@@H](CN12)[C@@H]34	C15H24N2O	unknown
+CCCNC(Cc1c[nH]c2ccccc12)C(=O)O	C14H18N2O2	tryptamine
+CCCN(CCc1c[nH]c2ccc(OC)cc12)C(C)C	C17H26N2O	tryptamine
+CCC1(c2ccccc2)C(=O)NC(=O)N(C(=O)c2ccccc2)C1=O	C19H16N2O4	unknown
+COc1cc2c(cc1OC)-c1cc3ccc(OC)c(OC)c3c[n+]1CC2	C21H22NO4	unknown
+O=c1cc(-c2ccccc2)oc2cc(O)c(O)c(O)c12	C15H10O5	unknown
+O=C(O)[C@H]1O[C@@H](Oc2cc3oc(-c4ccccc4)cc(=O)c3c(O)c2O)[C@H](O)[C@@H](O)[C@@H]1O	C21H18O11	unknown
+NC(=O)CS(=O)C(c1ccccc1)c1ccc(Cl)cc1	C15H14ClNO2S	unknown
+NC(=O)CS(=O)C(c1ccccc1)c1ccc(F)cc1	C15H14FNO2S	unknown
+CN(C)CCOC(=O)COc1ccc(Cl)cc1	C12H16ClNO3	unknown
+O=C(O)CCCNC(=O)c1cccnc1	C10H12N2O3	unknown
+NC(=O)CN1CC(c2ccc(Cl)cc2)CC1=O	C12H13ClN2O2	unknown
+CCC(=O)n1cc2c3c(cccc31)C1=C[C@@H](C(=O)N(CC)CC)CN[C@@H]1C2	C22H27N3O2	unknown
+O=C1CCC2CN(S(=O)(=O)c3ccc(F)cc3)CCN12	C13H15FN2O3S	unknown
+O=C1CN=C(c2ccccc2)c2cc(F)ccc2N1	C15H11FN2O	aryldiazepine
+CN1C(=O)CN=C(c2ccccc2)c2cc(F)ccc21	C16H13FN2O	aryldiazepine
+O=C1CN=C(c2ccccc2F)c2cc(F)ccc2N1	C15H10F2N2O	aryldiazepine
+O=C1CN=C(c2c(Cl)cccc2Cl)c2cc(Cl)ccc2N1	C15H9Cl3N2O	aryldiazepine
+CN1C(=O)CN=C(c2ccccc2F)c2cc(NO)ccc21	C16H14FN3O2	aryldiazepine
+Nc1ccc2c(c1)C(c1ccccc1)=NCC(=O)N2	C15H13N3O	aryldiazepine
+CN1C(=O)CN=C(c2ccccc2)c2cc(N)ccc21	C16H15N3O	aryldiazepine
+CC(=O)Nc1ccc2c(c1)C(c1ccccc1)=NCC(=O)N2	C17H15N3O2	aryldiazepine
+CNC(=O)Nc1ccc2c(c1)C(c1ccccc1F)=NCC(=O)N2C	C18H17FN4O2	aryldiazepine
+CN1C(=O)CN=C(c2ccccc2)c2cc(CN)ccc21	C17H17N3O	aryldiazepine
+CN(C)S(=O)(=O)c1ccc2c(c1)C(c1ccccc1)=NCC(=O)N2	C17H17N3O3S	aryldiazepine
+O=Cc1ccc2c(c1)C(c1ccccc1)=NCC(=O)N2	C16H12N2O2	aryldiazepine
+CC1=NCC(=O)Nc2ccccc21	C10H10N2O	aryldiazepine
+O=C1CN=C(c2ccccc2F)c2ccccc2N1	C15H11FN2O	aryldiazepine
+O=C1CN=C(c2c(F)cccc2F)c2ccccc2N1	C15H10F2N2O	aryldiazepine
+CN1C(=O)CN=C(c2ccccc2F)c2ccccc21	C16H13FN2O	aryldiazepine
+O=C1CN=C(c2ccccc2)c2c(Cl)cccc2N1	C15H11ClN2O	aryldiazepine
+O=C1CN=C(c2c(F)cccc2F)c2ccc(Cl)cc2N1	C15H9ClF2N2O	aryldiazepine
+Cc1ccc2c(c1)NC(=O)CN=C2c1ccccc1F	C16H13FN2O	aryldiazepine
+CN1C(=O)CN=C(c2ccccc2F)c2cccc(Cl)c21	C16H12ClFN2O	aryldiazepine
+CN1C(=O)CN=C(c2ccccc2)c2cc(Cl)c(Cl)cc21	C16H12Cl2N2O	aryldiazepine
+O=C1CN=C(c2ccccc2)c2c(Cl)cc(Cl)cc2N1	C15H10Cl2N2O	aryldiazepine
+CN1C(=O)CN=C(c2ccccc2F)c2c(N)cc(Cl)cc21	C16H13ClFN3O	aryldiazepine
+O=C1CN=C(c2ccccc2Cl)c2ccsc2N1	C13H9ClN2OS	aryldiazepine
+O=C1CN=C(c2ccccc2)c2cc(Cl)sc2N1	C13H9ClN2OS	aryldiazepine
+O=C1CN=C(c2ccccc2Cl)c2sc(Cl)cc2N1	C13H8Cl2N2OS	aryldiazepine
+NCCN1C(=O)CN=C(c2ccccc2)c2ccccc21	C17H17N3O	aryldiazepine
+O=C(O)CN1C(=O)CN=C(c2ccccc2F)c2cc(Cl)ccc21	C17H12ClFN2O3	aryldiazepine
+CC(C)(C)N1C(=O)CN=C(c2ccccc2)c2cc(Cl)ccc21	C19H19ClN2O	aryldiazepine
+NCCN1C(=O)CN=C(c2ccccc2F)c2cc(Cl)ccc21	C17H15ClFN3O	aryldiazepine
+CC(C)(C)N1C(=O)CN=C(c2ccccc2F)c2cc([N+](=O)[O-])ccc21	C19H18FN3O3	aryldiazepine
+CN1CC(=O)Nc2ccc([N+](=O)[O-])cc2C1c1ccccc1Cl	C16H14ClN3O3	aryldiazepine
+O=C1CN=C(C2CCCCC2)c2cc(Cl)ccc2N1	C15H17ClN2O	aryldiazepine
+CN1C(=O)CN=C(c2cccnn2)c2cc(Cl)ccc21	C14H11ClN4O	aryldiazepine
+CC1N=C(c2ccccc2F)c2cc([N+](=O)[O-])ccc2N(C)C1=O	C17H14FN3O3	aryldiazepine
+CC1N=C(c2ccccc2)c2cc(Cl)ccc2N(Cl)C1=O	C16H12Cl2N2O	aryldiazepine
+O=C1Nc2ccc(Cl)cc2C(c2ccccc2F)=NC1Cl	C15H9Cl2FN2O	aryldiazepine
+Cc1nnc2n1-c1ccccc1C(c1ccccc1Cl)=NC2	C17H13ClN4	aryldiazepine
+Cc1nnc2n1-c1ccc(I)cc1C(c1ccccc1F)=NC2	C17H12FIN4	aryldiazepine
+Cc1nnc2n1-c1ccc(C(F)(F)F)cc1C(c1ccccc1)=NC2	C18H13F3N4	aryldiazepine
+CNCc1nnc2n1-c1ccc(Cl)cc1C(c1ccccc1)=NC2	C18H16ClN5	aryldiazepine
+Cc1nnc2n1-c1ccc([N+](=O)[O-])cc1C(c1ccccc1F)=NC2C	C18H14FN5O2	aryldiazepine
+Cc1nnc2n1-c1sccc1C(c1ccccc1Cl)=NC2	C15H11ClN4S	aryldiazepine
+Cc1nnc2n1-c1sc(C(C)C)cc1C(c1ccccc1Cl)=NC2	C18H17ClN4S	aryldiazepine
+Cc1nnc2n1-c1sc(Cl)cc1C(c1ccccc1Cl)=NC2	C15H10Cl2N4S	aryldiazepine
+Cc1nnc2n1-c1sc(I)cc1C(c1ccccc1Cl)=NC2	C15H10ClIN4S	aryldiazepine
+NCc1nnc2n1-c1sc(Cl)cc1C(c1ccccc1Cl)=NC2	C15H11Cl2N5S	aryldiazepine
+CC(C)(C)OC(=O)c1ncn2c1CN=C(c1ccccc1)c1c(Cl)cccc1-2	C22H20ClN3O2	aryldiazepine
+COC(=O)c1ncn2c1CN=C(c1ccccc1F)c1cc(Cl)ccc1-2	C19H13ClFN3O2	aryldiazepine
+CC(C)OC(=O)c1ncn2c1C[N+]([O-])=C(c1ccccc1F)c1cc(Cl)ccc1-2	C21H17ClFN3O3	aryldiazepine
+O=C(O)c1ncn2c1CN=C(c1ccccc1Cl)c1cc(Cl)ccc1-2	C18H11Cl2N3O2	aryldiazepine
+NC(=O)c1ncn2c1CN=C(c1ccccc1Cl)c1cc(Cl)ccc1-2	C18H12Cl2N4O	aryldiazepine
+NC(=O)c1ncn2c1CN=C(c1ccccc1Cl)c1ccccc1-2	C18H13ClN4O	aryldiazepine
+O=C1CC=C(c2ccccc2F)c2cc(Cl)ccc2N1	C16H11ClFNO	aryldiazepine
+Cc1nnc2n1-c1ccccc1C(c1ccccc1)=CC2	C18H15N3	aryldiazepine
+Fc1ccccc1C1=CCc2nncn2-c2ccc(Cl)cc21	C17H11ClFN3	aryldiazepine
+Cc1nnc2n1-c1ccc(Cl)cc1C(c1ccccc1F)=CC2	C18H13ClFN3	aryldiazepine
+NCc1nnc2n1-c1ccc(Cl)cc1C(c1ccccc1F)=CC2	C18H14ClFN4	aryldiazepine
+Fc1ccccc1C1CCc2nncn2-c2ccc(Cl)cc21	C17H13ClFN3	aryldiazepine
+COC(=O)c1ncn2c1CC=C(c1ccccc1)c1ccccc1-2	C20H16N2O2	aryldiazepine
+CCOC(=O)c1ncn2c1CC=C(c1ccccc1)c1ccccc1-2	C21H18N2O2	aryldiazepine
+Cc1nnc2n1-c1ccc(Cl)cc1C(c1ccccc1)=CC2	C18H14ClN3	aryldiazepine
+CCOC(=O)c1ncn2c1CC=C(c1ccccc1F)c1cc(Cl)ccc1-2	C21H16ClFN2O2	aryldiazepine
+Fc1ccccc1C1=CCc2cncn2-c2ccc(Cl)cc21	C18H12ClFN2	aryldiazepine
+Cc1ncc2c(n1)-c1ccc(Cl)cc1C(c1ccccc1)=NC2	C19H14ClN3	aryldiazepine
+Cc1ncc2c(n1)-c1ccc(Cl)cc1C(c1ccccc1F)=NC2	C19H13ClFN3	aryldiazepine
+c1ccc(C2=NCc3n[nH]nc3-c3ccccc32)cc1	C16H12N4	aryldiazepine
+Clc1ccccc1C1=NCc2n[nH]nc2-c2ccccc21	C16H11ClN4	aryldiazepine
+Clc1ccc2c(c1)C(c1ccccc1)=NCc1n[nH]nc1-2	C16H11ClN4	aryldiazepine
+Fc1ccccc1C1=NCc2n[nH]nc2-c2ccc(Cl)cc21	C16H10ClFN4	aryldiazepine
+O=C1NCC2=C1CN=C(c1ccccc1Cl)c1cc(Cl)ccc12	C18H12Cl2N2O	aryldiazepine
+CCOC(=O)c1ncn2c1C1CCCN1C(=O)c1cc(Cl)ccc1-2	C17H16ClN3O3	aryldiazepine
+COc1cccc2c1C(=O)N1CCCC1c1c(C(=O)OC(C)(C)C)ncn1-2	C20H23N3O4	aryldiazepine
+CCc1cccc2c1C(=O)N1CCCC1c1c(C(=O)OC(C)(C)C)ncn1-2	C21H25N3O3	aryldiazepine
+Cc1cccc2c1C(=O)N1CCCC1c1c(C(=O)OC(C)(C)C)ncn1-2	C20H23N3O3	aryldiazepine
+CC(C)(C)OC(=O)c1ncn2c1C1CCCN1C(=O)c1ccccc1-2	C19H21N3O3	aryldiazepine
+CSc1cccc2c1C(=O)N1CCCC1c1c(C(=O)OC(C)(C)C)ncn1-2	C20H23N3O3S	aryldiazepine
+CC(C)(C)OC(=O)c1ncn2c1C1CCCN1C(=O)c1cc(F)ccc1-2	C19H20FN3O3	aryldiazepine
+CC(C)(C)OC(=O)c1ncn2c1C1CCCN1C(=O)c1c-2ccc(F)c1Cl	C19H19ClFN3O3	aryldiazepine
+CC(C)(C)OC(=O)c1ncn2c1C1CCCN1C(=O)c1c-2cccc1C(F)(F)F	C20H20F3N3O3	aryldiazepine
+CC(C)(C)OC(=O)c1ncn2c1C1CCCN1C(=O)c1c-2cccc1[N+](=O)[O-]	C19H20N4O5	aryldiazepine
+CCCOC(=O)c1ncn2c1C1CCCN1C(=O)c1c(Cl)cccc1-2	C18H18ClN3O3	aryldiazepine
+CC(C)OC(=O)c1ncn2c1C1CCCN1C(=O)c1c(Cl)cccc1-2	C18H18ClN3O3	aryldiazepine
+C=CCOC(=O)c1ncn2c1C1CCCN1C(=O)c1c(Cl)cccc1-2	C18H16ClN3O3	aryldiazepine
+CCC(C)OC(=O)c1ncn2c1C1CCCN1C(=O)c1c(Cl)cccc1-2	C19H20ClN3O3	aryldiazepine
+O=C(OCC1CC1)c1ncn2c1C1CCCN1C(=O)c1c(Cl)cccc1-2	C19H18ClN3O3	aryldiazepine
+O=C(OC1CCCCC1)c1ncn2c1C1CCCN1C(=O)c1c(Cl)cccc1-2	C21H22ClN3O3	aryldiazepine
+O=C(Oc1ccccc1)c1ncn2c1C1CCCN1C(=O)c1c(Cl)cccc1-2	C21H16ClN3O3	aryldiazepine
+CN1Cc2c(C(N)=O)ncn2-c2ccccc2C1=O	C13H12N4O2	aryldiazepine
+CCOC(=O)c1ncn2c1CN(C)C(=O)c1ccc(Cl)cc1-2	C15H14ClN3O3	aryldiazepine
+CCOC(=O)c1ncn2c1CN(C)C(=O)c1cccc(Cl)c1-2	C15H14ClN3O3	aryldiazepine
+CCOC(=O)c1ncn2c1CN(C)C(=O)c1cc(C3CC3)ccc1-2	C18H19N3O3	aryldiazepine
+C=CCc1ccc2c(c1)C(=O)N(C)Cc1c(C(=O)OCC)ncn1-2	C18H19N3O3	aryldiazepine
+CCOC(=O)c1ncn2c1CN(C)C(=O)c1cc(-c3ccco3)ccc1-2	C19H17N3O4	aryldiazepine
+CCOC(=O)c1ncn2c1CN(C)C(=O)c1cc(-c3ccccc3)ccc1-2	C21H19N3O3	aryldiazepine
+CCOC(=O)c1ncn2c1CN(C)C(=O)c1cc(-c3cccs3)ccc1-2	C19H17N3O3S	aryldiazepine
+CN1Cc2c(C(=O)OC3CC3)ncn2-c2ccc(Cl)cc2C1=O	C16H14ClN3O3	aryldiazepine
+CN1Cc2c(C(=O)OC(C)(C)C)ncn2-c2ccc(N3CCCC3)cc2C1=O	C21H26N4O3	aryldiazepine
+CN1Cc2c(C(=O)OC(C)(C)C)ncn2-c2ccc(N3CCCCC3)cc2C1=O	C22H28N4O3	aryldiazepine
+CN1Cc2c(C(=O)OC(C)(C)C)ncn2-c2ccc(N(C)C)cc2C1=O	C19H24N4O3	aryldiazepine
+COc1ccc2c(c1)C(=O)N(C)Cc1c(C(=O)OC(C)(C)C)ncn1-2	C18H21N3O4	aryldiazepine
+CN1Cc2c(C(=O)OC(C)(C)C)ncn2-c2ccsc2C1=O	C15H17N3O3S	aryldiazepine
+COC(=O)c1ncn2c1C1CCN1C(=O)c1c(Cl)cccc1-2	C15H12ClN3O3	aryldiazepine
+CC(C)(C)OC(=O)c1ncn2c1C1CCN1C(=O)c1c(Cl)cccc1-2	C18H18ClN3O3	aryldiazepine
+Cc1nnc2n1-c1ccc(Cl)cc1C(c1ccccc1F)=N[C@H]2C	C18H14ClFN4	aryldiazepine
+CN(C)Cc1nc(C(N)=O)c2n1-c1ccc(Cl)cc1C(c1ccccc1Cl)=NC2	C21H19Cl2N5O	aryldiazepine
+COc1cc(C(F)(F)F)ccc1CCN	C10H12F3NO	unknown
+COc1cc(C(F)(F)F)ccc1C(O)CN	C10H12F3NO2	unknown
+COc1cc(C(F)(F)F)ccc1C(CN)OC	C11H14F3NO2	unknown
+COc1c(CCN)ccc(C)c1C	C11H17NO	unknown
+COC(CN)c1ccc(SC(F)(F)F)cc1	C10H12F3NOS	unknown
+COc1cc(CCN)cc(OC)c1OCC(C)F	C13H20FNO3	unknown
+COc1c(CCN)ccc2sccc12	C11H13NOS	unknown
+CC1NCCOC1c1ccc(Cl)c(Cl)c1	C11H13Cl2NO	unknown
+C=C(C)CSc1cc(OC)c(CC(C)N)cc1OC	C15H23NO2S	unknown
+COc1cc(OCc2ccc(F)cc2)c(OC)cc1CC(C)N	C18H22FNO3	unknown
+CNCC(OC)c1cc(OC)c(Br)cc1OC	C12H18BrNO3	unknown
+CC(C)(C)CNCCc1c[nH]c2ccccc12	C15H22N2	tryptamine
+CC(Cc1c[nH]c2ccccc12)NCC(C)(C)C	C16H24N2	tryptamine
+CCC(Cc1c(OC)cc(I)cc1OC)N(C)C	C14H22INO2	unknown
+CCC(Cc1c(OC)cc(Br)cc1OC)N(C)C	C14H22BrNO2	unknown
+CCC(Cc1cc(OC)c(I)cc1OC)N(C)C	C14H22INO2	unknown
+CCC(Cc1cc(OC)c(Br)cc1OC)N(C)C	C14H22BrNO2	unknown
+COc1ccc(O)cc1CC(C)N(C)C	C12H19NO2	unknown
+COc1cc(OC)c(C(O)C(C)N)cc1OC	C12H19NO4	unknown
+COc1cc(C(SC)C(C)N)c(OC)cc1Br	C12H18BrNO2S	unknown
+COc1cc(O)c(CCN)cc1OC	C10H15NO3	unknown
+COc1cccc(CCNCc2ccccc2F)c1OC	C17H20FNO2	unknown
+COc1ccc(CCNCc2ccccc2F)c(OC)c1	C17H20FNO2	unknown
+COc1cccc(OC)c1CCNCc1ccccc1F	C17H20FNO2	unknown
+COc1ccc(CCNCc2ccccc2F)cc1OC	C17H20FNO2	unknown
+COc1cc(CCNCc2ccccc2F)cc(OC)c1	C17H20FNO2	unknown
+CC(C)N(C)CCc1ccc2c(c1)OCO2	C13H19NO2	unknown
+CCC(N)Cc1c(OC)ccc(OC)c1OC	C13H21NO3	unknown
+COc1ccc2[nH]cc(CC(N)C(=O)O)c2c1	C12H14N2O3	tryptamine
+CC1=NC(C)Cc2cc3c(cc21)OCO3	C12H13NO2	unknown
+CNCCCC(=O)O	C5H11NO2	unknown
+CC(O)CCC(=O)O	C5H10O3	unknown
+C[C@@H]([C@@H](O)c1ccccc1)N(C)C	C11H17NO	unknown
+CCOC(=O)N1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1	C22H23ClN2O2	unknown
+CC(=O)Cc1ccc(C(C)(C)C)cc1	C13H18O	unknown
+Clc1ccc2c(c1)CCc1cccnc1C2=C1CCNCC1	C19H19ClN2	unknown
+CNC(C)C(O)c1ccc2c(c1)OCO2	C11H15NO3	unknown
+CNC(C)C(=O)O	C4H9NO2	unknown
+CC(NC(=O)OC(C)(C)C)C(=O)O	C8H15NO4	unknown
+CC(C(=O)O)N(C)C(=O)OC(C)(C)C	C9H17NO4	unknown
+CN(C)CCC(c1ccccc1)c1ccccn1	C16H20N2	unknown
+Cc1ccc(/C(=C\CN2CCCC2)c2ccccn2)cc1	C19H22N2	unknown
+CCCC(=O)N(CCc1cc(OC)c(I)cc1OC)Cc1ccccc1OC	C22H28INO4	unknown
+COc1cc(CCN(Cc2ccccc2OC)C(=O)C(C)C)c(OC)cc1I	C22H28INO4	unknown
+COc1cc(CCN(Cc2ccccc2OC)C(=O)C(F)(F)C(F)(F)F)c(OC)cc1I	C21H21F5INO4	unknown
+COc1c(CC(C)NC(C)=O)cc2c(c1OC)OCO2	C14H19NO5	unknown
+NC(CCl)Cc1ccccc1	C9H12ClN	unknown
+CNC(C)CC1=CCCCC1	C10H19N	unknown
+CNC(C)C(O)C1=CCCCC1	C10H19NO	unknown
+CC(=O)N(C)C(C)Cc1ccccc1	C12H17NO	unknown
+CC(=O)O[C@@H](c1ccccc1)[C@H](C)N(C)C(C)=O	C14H19NO3	unknown
+CCCCC(=O)n1cc2c3c(cccc31)C1=C[C@@H](C(=O)N(CC)CC)CN(C)[C@@H]1C2	C25H33N3O2	unknown
+CCCOc1ccc(Cc2nc3cc([N+](=O)[O-])ccc3n2CCN(CC)CC)cc1	C23H30N4O3	unknown
+CCCCCCn1nc(C(=O)N[C@H](C(N)=O)C(C)(C)C)c2ccccc21	C20H30N4O2	cannabinoid
+COc1cc(CC(C)N)c(OC)cc1CCCCCCS	C17H29NO2S	unknown
+C=CCCCn1cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)OC)c2cccnc21	C23H25N3O3	cannabinoid
+C=CCCCn1cc(C(=O)N[C@H](C(N)=O)C(C)C)c2cccnc21	C18H24N4O2	cannabinoid
+C=CCCCn1cc(C(=O)N[C@H](C(N)=O)C(C)(C)C)c2cccnc21	C19H26N4O2	cannabinoid
+C=CCCCn1cc(C(=O)N[C@@H](Cc2ccccc2)C(N)=O)c2cccnc21	C22H24N4O2	cannabinoid
+C=CCCCn1cc(C(=O)NC23CC4CC(CC(C4)C2)C3)c2cccnc21	C23H29N3O	cannabinoid
+C=CCCCn1cc(C(=O)NC(C)(C)c2ccccc2)c2cccnc21	C22H25N3O	cannabinoid
+CCCCn1cc(C(=O)N[C@H](C(=O)OC)C(C)C)c2cccnc21	C18H25N3O3	cannabinoid
+COC(=O)[C@@H](NC(=O)c1cn(CCCCC#N)c2ncccc12)C(C)C	C19H24N4O3	cannabinoid
+O=C(N[C@@H]1C=CC2[C@H]3Cc4ccc(O)c5c4[C@@]2(CCN3CC2CC2)[C@H]1O5)c1cccc(I)c1	C27H27IN2O3	unknown
+O=C(N[C@@H]1CCC2[C@H]3Cc4ccc(O)c5c4[C@@]2(CCN3CC2CC2)[C@H]1O5)c1cccc(I)c1	C27H29IN2O3	unknown
+O=C(N[C@@H]1CC[C@@]2(O)[C@H]3Cc4ccc(O)c5c4[C@@]2(CCN3CC2CC2)[C@H]1O5)c1cccc(I)c1	C27H29IN2O4	unknown
+NCc1cccc(C(=O)N[C@@H]2CCC3[C@H]4Cc5ccc(O)c6c5[C@@]3(CCN4CC3CC3)[C@H]2O6)c1	C28H33N3O3	unknown
+N=C(N)NCc1cccc(C(=O)N[C@@H]2CCC3[C@H]4Cc5ccc(O)c6c5[C@@]3(CCN4CC3CC3)[C@H]2O6)c1	C29H35N5O3	unknown
+CO[C@@]12CC[C@@H](NC(=O)c3cccc(I)c3)[C@@H]3Oc4c(O)ccc5c4[C@@]31CCN(CC1CC1)[C@@H]2C5	C28H31IN2O4	unknown
+O=C(N[C@@H]1CC[C@@]2(O)[C@H]3Cc4ccc(O)cc4[C@@]2(CCN3CC2CC2)C1)c1cccc(I)c1	C27H31IN2O3	unknown
+NCc1ccc(C(=O)N[C@@H]2CCC3[C@H]4Cc5ccc(O)c6c5[C@@]3(CCN4CC3CC3)[C@H]2O6)cc1	C28H33N3O3	unknown
+O=C(N[C@@H]1CCC2[C@H]3Cc4ccc(O)c5c4[C@@]2(CCN3CC2CC2)[C@H]1O5)c1cccc(CO)c1	C28H32N2O4	unknown
+CCCC(=O)N(c1ccccc1)C1(C(=O)NC2CCCCCC2)CCN(CCc2ccccc2)CC1	C31H43N3O2	fentanyl
+CC[C@@H]1CN2CCc3c([nH]c4cccc(O)c34)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC	C22H28N2O4	unknown
+COc1ccc(C(=O)Cc2c(CCN(C)C)cc3c(c2OC)OCO3)c(C(=O)O)c1OC	C23H27NO8	unknown
+C[C@@H](Cc1ccsc1)NC(=O)NC[C@H](Cc1ccccc1)N(C)C	C19H27N3OS	unknown
+CN(C)[C@H](CNC(=O)NCCc1ccccc1)Cc1ccc(O)cc1	C20H27N3O2	unknown
+C[C@@H](Cc1csc2ccccc12)NC(=O)NC[C@H](Cc1ccc(O)cc1)N(C)C	C23H29N3O2S	unknown
+CN(C)[C@H](CNC(=O)NCCc1cn(CCSSCCN=[N+]=[N-])nn1)Cc1ccc(O)cc1	C20H31N9O2S2	unknown
+C[C@@H](Cc1ccsc1)NC(=O)NC[C@H](Cc1ccc(O)cc1)[NH+](C)CC1CC1	C22H31N3O2S	unknown
+C[C@@H](Cc1ccsc1)NC(=O)NC[C@H](Cc1ccc(O)cc1)N(C)C=O	C19H25N3O3S	unknown
+C[C@@H](Cc1ccsc1)N(C)C(=O)NC[C@H](Cc1ccc(O)cc1)N(C)C	C20H29N3O2S	unknown
+C[C@@H](Cc1ccsc1)NC(=O)N(C)C[C@H](Cc1ccc(O)cc1)N(C)C	C20H29N3O2S	unknown
+C[C@@H](Cc1ccsc1)N(C)C(=O)N(C)C[C@H](Cc1ccc(O)cc1)N(C)C	C21H31N3O2S	unknown
+NCCc1c[nH]c2ccc(F)cc12	C10H11FN2	tryptamine
+c1csc(C2(N3CCOCC3)CCCCC2)c1	C14H21NOS	unknown
+O=C(OC1CC2CCC(C1)[N+]21CCCC1)C(O)(c1ccccc1)c1ccccc1	C25H30NO3	unknown
+O=C(OCCN1CCCCC1)C(O)(c1ccccc1)C1CCCCC1	C21H31NO3	unknown
+O=C(OC1C[N+]2(CCCOc3ccccc3)CCC1CC2)C(O)(c1cccs1)c1cccs1	C26H30NO4S2	unknown
+O=C(OC1CN2CCC1CC2)C(c1ccccc1)c1ccccc1	C21H23NO2	unknown
+O=C(OC1CN2CCC1CC2)C1c2ccccc2Oc2ccccc21	C21H21NO3	unknown
+CN1C(C)(C)CCC(OC(=O)C(O)(c2ccccc2)c2ccccc2)C1(C)C	C24H31NO3	unknown
+c1ccc(C(OC2CN3CCC2CC3)c2ccccc2)cc1	C20H23NO	unknown
+Cc1ccccc1C(OC1CN2CCC1CC2)c1ccccc1	C21H25NO	unknown
+Clc1ccccc1C(OC1CN2CCC1CC2)c1ccccc1	C20H22ClNO	unknown
+CN1C2CCC1CC(OC(=O)C(O)(c1ccccc1)c1ccccc1)C2	C22H25NO3	unknown
+CN1C2CCC1CC(OC(=O)C1(O)c3ccccc3-c3ccccc31)C2	C22H23NO3	unknown
+O=C(OC1CN2CCC1CC2)C1(O)c2ccccc2-c2ccccc21	C21H21NO3	unknown
+O=C(OC1CN2CCC1CC2)C(O)(c1ccccc1)C1CCCC1	C20H27NO3	unknown
+O=C(OC1CN2CCC1CC2)C(O)(c1ccccc1)c1cccs1	C19H21NO3S	unknown
+O=C(OC1CN2CCC1CC2)C(O)(c1cccs1)c1cccs1	C17H19NO3S2	unknown
+O=C(OC1CN2CCC1CC2)C(O)(c1ccsc1)c1ccsc1	C17H19NO3S2	unknown
+C[N+]1(C)C2CCC1CC(OC(=O)C(CO)c1ccccc1)C2	C18H26NO3	unknown
+CN1CCCC(OC(=O)C(c2ccccc2)c2ccccc2)C1	C20H23NO2	unknown
+CCN1CCCC(OC(=O)C(c2ccccc2)c2ccccc2)C1	C21H25NO2	unknown
+CN1CCC(OC(=O)C(c2ccccc2)c2ccccc2)CC1	C20H23NO2	unknown
+CN1C2CCC(OC(=O)C(c3ccccc3)c3ccccc3)C1CC2	C22H25NO2	unknown
+CN1CCC(OC(=O)C(O)(c2ccccc2)c2ccccc2)CC1	C20H23NO3	unknown
+CN1C2CCC(OC(=O)C(O)(c3ccccc3)c3ccccc3)C1CC2	C22H25NO3	unknown
+CN1CCC(OC(=O)C(O)(c2ccccc2)C2CCCCC2)CC1	C20H29NO3	unknown
+CN1C2CCC(OC(=O)C(O)(c3ccccc3)C3CCCCC3)C1CC2	C22H31NO3	unknown
+O=C(OC1CN2CCC1CC2)C(O)(c1ccccc1)C1CCCCC1	C21H29NO3	unknown
+CN1C2CCC(OC(=O)C(O)(c3ccccc3)c3cccs3)C1CC2	C20H23NO3S	unknown
+CN1C2CCC(OC(=O)C(O)(c3ccccc3)C3CCCC3)C1CC2	C21H29NO3	unknown
+CN1C2CCC(OC(=O)C(O)(c3ccccc3)C3CCC3)C1CC2	C20H27NO3	unknown
+CC(C)C(O)(C(=O)OC1CCC2CCC1N2C)c1ccccc1	C19H27NO3	unknown
+C=C(C)C(O)(C(=O)OC1CCC2CCC1N2C)c1ccccc1	C19H25NO3	unknown
+CN1C2CCC(OC(=O)C(O)(c3cccs3)C3CCCCC3)C1CC2	C20H29NO3S	unknown
+CN1C2CCC(OC(=O)C(O)(c3cccs3)C3CCCC3)C1CC2	C19H27NO3S	unknown
+CN1C2CCC1CC(OC(=O)C(O)(c1ccccc1)C1CCCC1)C2	C21H29NO3	unknown
+CN1CCC(OC(=O)C(O)(c2ccccc2)C2CCCC2)CC1	C19H27NO3	unknown
+CN1CCC(OC(=O)C(O)(c2ccccc2)C2CCC2)CC1	C18H25NO3	unknown
+CC(C)C(O)(C(=O)OC1CCN(C)CC1)c1ccccc1	C17H25NO3	unknown
+CC1C(OC(=O)C(O)(c2ccccc2)C2CCCC2)C2CCN1CC2	C21H29NO3	unknown
+CC(C)C(O)(C(=O)OC1=CCN(C)CC1)c1ccccc1	C17H23NO3	unknown
+CCCCC(O)(C(=O)OC1CN2CCC1CC2)c1ccccc1	C19H27NO3	unknown
+O=C(OC1CN2CCC1CC2)C(O)(c1ccccc1)c1cccc(F)c1	C21H22FNO3	unknown
+O=C(OC1CN2CCC1CC2)C(O)(c1ccccc1)c1ccc(F)cc1	C21H22FNO3	unknown
+O=C(OC1CN2CCC1CC2)C1c2ccccc2Sc2ccccc21	C21H21NO2S	unknown
+O=C(OC1CN2CCC1CC2)C1CCOc2ccccc21	C17H21NO3	unknown
+O=C(OC1CN2CCC1CC2)C1CCSc2ccccc21	C17H21NO2S	unknown
+O=C(OC1CN2CCC1CC2)C(O)(c1ccccc1)c1ccc(Br)cc1	C21H22BrNO3	unknown
+O=C(OC1CN2CCC1CC2)C(O)(c1ccc(Br)cc1)c1cccs1	C19H20BrNO3S	unknown
+O=C(OC1CN2CCC1CC2)C(O)(c1ccc(Br)cc1)c1ccsc1	C19H20BrNO3S	unknown
+O=C(OC1CN2CCC1CC2)C(O)(c1ccccc1)c1ccc(Br)s1	C19H20BrNO3S	unknown
+OC(c1ccccc1)(c1ccccc1)c1noc(C2CN3CCC2CC3)n1	C22H23N3O2	unknown
+CCN1CCC(OC(=O)C(O)(c2ccccc2)c2ccccc2)CC1	C21H25NO3	unknown
+O=C(OC1CCN(Cc2ccccc2)CC1)C(O)(c1ccccc1)c1ccccc1	C26H27NO3	unknown
+O=C(OC1CN2CCC1CC2)C(O)(c1ccccc1)c1ccc(CF)cc1	C22H24FNO3	unknown
+O=C(OC1CN2CCC1CC2)C(O)(c1ccccc1)c1ccc(CCF)cc1	C23H26FNO3	unknown
+O=C(OC1CN2CCC1CC2)C(O)(c1ccccc1)c1ccc(CCCF)cc1	C24H28FNO3	unknown
+O=C(OC1CN2CCC1CC2)C(O)(c1ccccc1)c1ccc(I)cc1	C21H22INO3	unknown
+CC(C)C(O)(C(=O)OCC1=CCN(C)CC1)c1ccccc1	C18H25NO3	unknown
+CC#CC(O)(C(=O)OC1CCN(C)CC1)C1CCCC1	C16H25NO3	unknown
+C=CCN1C[C@H](C)N(C(c2ccc(C(=O)N(CC)CC)cc2)c2cccc(O)c2)C[C@H]1C	C27H37N3O2	unknown
+C=CCN1C[C@H](C)N([C@H](c2ccc(C(=O)N(CC)CC)cc2)c2cccc(OC)c2)C[C@H]1C	C28H39N3O2	unknown
+C=CCN1C[C@H](C)N([C@H](c2ccc(C(=O)N(CC)CC)cc2)c2cccc(O)c2)C[C@H]1C	C27H37N3O2	unknown
+CO[C@]12C=C[C@@]3([C@@H]4CCC[C@H](O)[C@@H]41)[C@H]1Cc4ccc(O)c5c4[C@@]3(CCN1CC1CC1)[C@H]2O5	C27H33NO4	unknown
+COC(=O)[C@@H]1C2CCC(C[C@@H]1OC(=O)c1cc(OC)c(OC)c(OC)c1)N2C	C20H27NO7	unknown
+COc1cc(C(=O)O[C@@H]2C[C@H]3CC[C@@H](C2)N3C)cc(OC)c1OC	C18H25NO5	unknown
+COC(=O)[C@@H]1C2CCC(C[C@@H]1OC(=O)/C=C/c1cc(OC)c(OC)c(OC)c1)N2C	C22H29NO7	unknown
+COC(=O)[C@@H]1C2CCC(C[C@@H]1OC(=O)/C=C\c1cc(OC)c(OC)c(OC)c1)N2C	C22H29NO7	unknown
+CCC(=O)Nc1ccc(N(C(=O)CC)C2CCN(CCc3ccccc3)CC2)cc1	C25H33N3O2	fentanyl
+CCC(=O)N(Cc1ccccc1)C1CCN(CCc2ccccc2)CC1	C23H30N2O	fentanyl
+COc1ccc(CC(=O)N(c2ccccc2)C2CCN(CCc3ccccc3)CC2)cc1	C28H32N2O2	unknown
+CCC(=O)N(C1CCCCC1)C1CCN(CCc2ccccc2)CC1	C22H34N2O	unknown
+CCC(=O)N(c1ccc(-c2ccc(N(C(=O)CC)C3CCN(CCc4ccccc4)CC3)cc2)cc1)C1CCN(CCc2ccccc2)CC1	C44H54N4O2	unknown
+O=[N+]([O-])c1ccc(NC2CCN(CCc3ccccc3)CC2)cc1	C19H23N3O2	unknown
+COc1ccc(CC(=O)N(c2ccc([N+](=O)[O-])cc2)C2CCN(CCc3ccccc3)CC2)cc1	C28H31N3O4	unknown
+CC(CCO)C(=O)O	C5H10O3	unknown
+O=C(O)C(CCO)c1ccccc1	C10H12O3	unknown
+CC(CO)CC(=O)O	C5H10O3	unknown
+CCC(CO)CC(=O)O	C6H12O3	unknown
+CCCC(CO)CC(=O)O	C7H14O3	unknown
+CC(C)C(CO)CC(=O)O	C7H14O3	unknown
+O=C(O)CC(CO)c1ccccc1	C10H12O3	unknown
+O=C(O)CC(CO)Cc1ccccc1	C11H14O3	unknown
+CC(CO)C(C)C(=O)O	C6H12O3	unknown
+O=C(O)CCC(O)c1ccccc1	C10H12O3	unknown
+O=C(O)/C=C/CO	C4H6O3	unknown
+C/C(=C\C(=O)O)CO	C5H8O3	unknown
+O=C(O)/C=C(/CO)c1ccccc1	C10H10O3	unknown
+CC(O)/C=C/C(=O)O	C5H8O3	unknown
+O=C(O)/C=C/C(O)C1CCCCC1	C10H16O3	unknown
+O=C(O)/C=C/C(O)c1ccccc1	C10H10O3	unknown
+C/C(=C\c1cc2c(cc1Br)OCO2)[N+](=O)[O-]	C10H8BrNO4	unknown
+COc1cc(OC)c(/C=C(\C)[N+](=O)[O-])cc1Br	C11H12BrNO4	unknown
+O=C1NC(=Nc2ccccc2)OC1c1ccccc1	C15H12N2O2	unknown
+CC1N=C(N)OC1C	C5H10N2O	unknown
+CC1N=C(Nc2ccccc2)OC1c1ccccc1	C16H16N2O	unknown
+CC1N=C(N(C)c2ccccc2)OC1c1ccccc1	C17H18N2O	unknown
+CN=C1OC(c2ccccc2)C(C)N1C	C12H16N2O	unknown
+CC1C(c2ccccc2)OC(=Nc2ccccc2)N1C	C17H18N2O	unknown
+COc1cc(C(O)CN(C)C)cc(OC)c1OC	C13H21NO4	unknown
+CCOC(=O)NCC(O)c1cc(OC)c(OC)c(OC)c1	C14H21NO6	unknown
+CNC(=O)C(=O)c1cc(OC)c(OC)c(OC)c1	C12H15NO5	unknown
+CN=C(C(=O)NC)c1cc(OC)c(OC)c(OC)c1	C13H18N2O4	unknown
+CNCC(NC)c1cc(OC)c(OC)c(OC)c1	C13H22N2O3	unknown
+CNCC(Cl)c1cc(OC)c(OC)c(OC)c1	C12H18ClNO3	unknown
+CNCC(=O)c1cc(OC)c(OC)c(OC)c1	C12H17NO4	beta-ketone
+COc1cc(C(O)C/N=C/c2ccccc2)cc(OC)c1OC	C18H21NO4	unknown
+COc1cc(C(O)C/[N+](C)=C/c2ccccc2)cc(OC)c1OC	C19H24NO4	unknown
+COc1cc2c(c(OC)c1OC)CN(C)CC2O	C13H19NO4	unknown
+COc1cc(C2CN(C)CO2)cc(OC)c1OC	C13H19NO4	unknown
+CNS(=O)(=O)CCc1ccc2[nH]cc(C3CCN(C)CC3)c2c1	C17H25N3O2S	unknown
+CN[C@@H]1CCc2[nH]c3ccc(C(N)=O)cc3c2C1	C14H17N3O	unknown
+CC(C)c1ccc2[nH]cc(CCN)c2c1	C13H18N2	tryptamine
+CC(C)(C)c1ccc2[nH]cc(CCN)c2c1	C14H20N2	tryptamine
+NCCc1c[nH]c2ccc(C3CCCCC3)cc12	C16H22N2	tryptamine
+NCCc1c[nH]c2ccc(C3CCCC3)cc12	C15H20N2	tryptamine
+CNCCc1c[nH]c2ccc(C(C)(C)C)cc12	C15H22N2	tryptamine
+CN(C)CCc1c[nH]c2ccc(C(C)(C)C)cc12	C16H24N2	tryptamine
+CCCNCCc1c[nH]c2ccc(C(C)(C)C)cc12	C17H26N2	tryptamine
+CCCN(CCC)CCc1c[nH]c2ccc(C(C)(C)C)cc12	C20H32N2	tryptamine
+O=C(O)C1N=C(c2ccccc2)c2cc(Cl)ccc2NC1(O)O	C16H13ClN2O4	aryldiazepine
+NC1=NC(=O)C(c2ccccc2)O1	C9H8N2O2	unknown
+COc1ccc(OC)c(CCNC(=O)C(F)(F)F)c1	C12H14F3NO3	unknown
+COc1cc(CCNC(=O)C(F)(F)F)c(OC)cc1C=O	C13H14F3NO4	unknown
+COc1cc(CCNC(=O)C(F)(F)F)c(OC)cc1C#N	C13H13F3N2O3	unknown
+COc1cc(CCNC(=O)C(F)(F)F)c(OC)cc1/C=N/O	C13H15F3N2O4	unknown
+C=CCCCn1cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)OC)c2ccccc21	C24H26N2O3	cannabinoid
+C=CCCCn1cc(C(=O)N[C@H](C(N)=O)C(C)C)c2ccccc21	C19H25N3O2	cannabinoid
+C=CCCCn1cc(C(=O)N[C@H](C(N)=O)C(C)(C)C)c2ccccc21	C20H27N3O2	cannabinoid
+C=CCCCn1cc(C(=O)N[C@@H](Cc2ccccc2)C(N)=O)c2ccccc21	C23H25N3O2	cannabinoid
+C=CCCCn1cc(C(=O)NC23CC4CC(CC(C4)C2)C3)c2ccccc21	C24H30N2O	cannabinoid
+C=CCCCn1cc(C(=O)NC(C)(C)c2ccccc2)c2ccccc21	C23H26N2O	cannabinoid
+CCCCn1cc(C(=O)N[C@H](C(=O)OC)C(C)C)c2ccccc21	C19H26N2O3	cannabinoid
+COC(=O)[C@@H](NC(=O)c1cn(CCCCC#N)c2ccccc12)C(C)C	C20H25N3O3	cannabinoid
+C=CCCCn1nc(C(=O)N[C@@H](Cc2ccccc2)C(=O)OC)c2ccccc21	C23H25N3O3	cannabinoid
+C=CCCCn1nc(C(=O)N[C@@H](Cc2ccccc2)C(N)=O)c2ccccc21	C22H24N4O2	cannabinoid
+C=CCCCn1nc(C(=O)NC23CC4CC(CC(C4)C2)C3)c2ccccc21	C23H29N3O	cannabinoid
+C=CCCCn1nc(C(=O)NC(C)(C)c2ccccc2)c2ccccc21	C22H25N3O	cannabinoid
+CCCCn1nc(C(=O)N[C@H](C(=O)OC)C(C)C)c2ccccc21	C18H25N3O3	cannabinoid
+COC(=O)[C@@H](NC(=O)c1nn(CCCCC#N)c2ccccc12)C(C)C	C19H24N4O3	cannabinoid
+C=CCCCn1cc(C(=O)N[C@H](C(=O)OC)C(C)C)c2cccnc21	C19H25N3O3	cannabinoid
+C=CCCCn1cc(C(=O)N[C@H](C(=O)OC)C(C)(C)C)c2cccnc21	C20H27N3O3	cannabinoid
+CC(C)(C)OC(=O)c1ncn2c1C1CCCN1C(=O)c1c(Cl)cccc1-2	C19H20ClN3O3	aryldiazepine
+CC(C)(C)OC(=O)c1ncn2c1C1CCCN1C(=O)c1cc(Cl)ccc1-2	C19H20ClN3O3	aryldiazepine
+CC(C)(c1ccccc1)n1ccc2c(c1=O)c1ccccc1n2CC1CCC1	C25H26N2O	cannabinoid
+CCCn1c(C)c(C(=O)Cc2ccc(OC)c(OC)c2)c2ccccc21	C22H25NO3	cannabinoid
+CCCCCn1cc(C(=O)c2c(OC)ccc3ccccc23)c2ccccc21	C25H25NO2	cannabinoid
+CC(C)(NC(=O)c1c2ccccc2nn1CCCCC#N)c1ccccc1	C22H24N4O	cannabinoid
+Cn1c(=O)c2c(n(C)c1=O)n(C)c(=O)n2C	C9H12N4O3	unknown
+CC(C)(c1ccccc1)n1ccc2c(c1=O)c1ccccc1n2CC1CC2CCC1C2	C28H30N2O	cannabinoid
+CCOC(=O)Nc1ccc(NCc2ccc(F)cc2)cc1N	C16H18FN3O2	unknown
+N#Cc1ccccc1-c1cc(-c2ccccn2)cn(-c2ccccc2)c1=O	C23H15N3O	unknown
+Cc1ccc(N(C)C(=O)C(C)C)cc1	C12H17NO	unknown
+CC(=O)Oc1ccc2c3c1O[C@H]1[C@@H](O)C=C[C@H]4[C@@H](C2)N(C)CC[C@@]341	C19H21NO4	unknown
+CC(C)c1cccc(C(C)C)c1O	C12H18O	unknown
+OC(O)C(Cl)(Cl)Cl	C2H3Cl3O2	unknown
+Cc1cc(C)cc(OCC2CNC(=O)O2)c1	C12H15NO3	unknown
+CN1CCN(C(c2ccccc2)c2ccccc2)CC1	C18H22N2	unknown
+O=C(c1cccs1)C1CCCCN1	C10H13NOS	unknown
+COC(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C17H18N2O2	unknown
+CCCC(F)Cn1cc(C(=O)c2ccc(C)c3ccccc23)c2ccccc21	C25H24FNO	cannabinoid
+CCC(F)CCn1cc(C(=O)c2ccc(C)c3ccccc23)c2ccccc21	C25H24FNO	cannabinoid
+Cc1ccc(C(=O)c2cn(CCCC(C)O)c3ccccc23)c2ccccc12	C25H25NO2	cannabinoid
+CC(C)[C@H](NC(=O)c1nn(CC2CCCCC2)c2ccccc12)C(=O)O	C20H27N3O3	cannabinoid
+C[C@H]1[C@H]2Cc3ccc(O)cc3[C@]1(C)CCN2CCc1ccccc1	C22H27NO	unknown
+C[C@H]1[C@H]2Cc3ccc(O)cc3[C@]1(C)CCN2C	C15H21NO	unknown
+C[C@H]1[C@H]2Cc3ccc(O)cc3[C@]1(C)CCN2CC1CC1	C18H25NO	unknown
+CC(CC(C#N)(c1ccccc1)c1ccccc1)N(C)C	C19H22N2	unknown
+CCC(=O)OC1(c2ccccc2)CCCN(C)CC1C	C17H25NO2	unknown
+CCOC(=O)C1(c2ccccc2)CCCN(C)CC1	C16H23NO2	unknown
+CCOC(=O)C1(c2ccccc2)CCCN(C)CC1C	C17H25NO2	unknown
+COC(=O)C1(c2ccccc2)CCCN(C)C(C)C1	C16H23NO2	unknown
+CCC(O)C(CC(C)N(C)C)(c1ccccc1)c1ccccc1	C21H29NO	unknown
+CC(C)C(NC(=O)c1nn(Cc2ccccc2)c2ccccc12)C(N)=O	C20H22N4O2	cannabinoid
+COc1ccc(CNc2ccccc2)cc1	C14H15NO	unknown
+CCCCCn1nc(C(=O)Nc2ccc3ncccc3c2)c2ccccc21	C22H22N4O	cannabinoid
+CCCCCn1cc(C(=O)Nc2cccc3ccccc23)c2cccnc21	C23H23N3O	cannabinoid
+O=C(Nc1cccc2ccccc12)c1n[nH]c2ccccc12	C18H13N3O	cannabinoid
+CC(=O)NC(C)C(=O)c1cccc(C)c1	C12H15NO2	beta-ketone
+CCOC(=O)C1(c2ccccc2)CCN(Cc2ccccc2)CC1	C21H25NO2	unknown
+CNC(C)C(=O)c1c(OC)ccc2c1OCO2	C12H15NO4	beta-ketone
+CN(C)C(Cc1ccccn1)c1ccccc1	C15H18N2	unknown
+C=CCCCn1cc(C(=O)c2cccc3ccccc23)c2cccnc21	C23H20N2O	cannabinoid
+C=CCN1CC[C@]23c4c5ccc(O)c4O[C@H]2[C@@H](OCCOCCOCCOCCOCCOCCOCCOC)CC[C@@]3(O)[C@H]1C5	C34H53NO11	unknown
+CCCN(CCc1c[nH]c2ccccc12)C1CC1	C16H22N2	tryptamine
+CCC(=O)C(CC(C)N1CCOCC1)(c1ccccc1)c1ccccc1	C23H29NO2	unknown
+CCCCCn1nc(C(=O)N2CCNCC2)c2ccccc21	C17H24N4O	cannabinoid
+CCCCCn1cc(C(=O)c2cccnc2)c2ccccc21	C19H20N2O	cannabinoid
+CC(C)C(=O)N(c1ccc(F)cc1)C1CCN(Cc2ccccc2)CC1	C22H27FN2O	fentanyl
+CN1CC[C@]23c4c5ccc(O)c4O[C@H]2[C@@H](O)C=C[C@@]3(O)[C@H]1C5	C17H19NO4	unknown
+c1ccc2c(Cc3c[nH]c4ccccc34)cccc2c1	C19H15N	cannabinoid
+c1ccc2cc(Cc3c[nH]c4ccccc34)ccc2c1	C19H15N	cannabinoid
+CN(C)CCC1CNc2ccccc21	C12H18N2	unknown
+Oc1ccccc1C1CCCC(O)C1	C12H16O2	cannabinoid
+NC1(c2ccccc2)CCCCC1=O	C12H15NO	arylcycloalkylamine
+CCNC(Cc1ccccc1Cl)c1ccccc1	C16H18ClN	unknown
+CCNC(Cc1ccccc1OC)c1ccccc1	C17H21NO	unknown
+c1ccc(CN2CCC(N(c3ccccc3)c3ccco3)CC2)cc1	C22H24N2O	fentanyl
+CC(CN1CCOCC1)C(C(=O)O)(c1ccccc1)c1ccccc1	C21H25NO3	unknown
+CC(C)(C(=O)c1ccccc1)c1cccnc1	C15H15NO	unknown
+O=C(c1cc[nH]c1)c1cccc2ccccc12	C15H11NO	unknown
+O=C(c1c[nH]c2ccccc12)C12CC3CC(CC(C3)C1)C2	C19H21NO	unknown
+C1=C(Cc2ccc3ccccc3c2)c2ccccc2C1	C20H16	unknown
+C1=C(Cc2cccc3ccccc23)c2ccccc2C1	C20H16	unknown
+CCCC(C(=O)c1ccc(CC)cc1)N1CCCC1	C17H25NO	beta-ketone
+CCCCC(C(=O)c1ccc(OC)cc1)N1CCCC1	C17H25NO2	beta-ketone
+CCCC(NC(C)C)C(=O)c1ccc(C)cc1	C15H23NO	beta-ketone
+CC(F)CCCn1nc(C(=O)N[C@H](C(N)=O)C(C)C)c2ccccc21	C18H25FN4O2	cannabinoid
+COC(=O)[C@@H](NC(=O)c1nn(CCCC(C)F)c2ccccc12)C(C)C	C19H26FN3O3	cannabinoid
+CC(C)(c1ccccc1)n1ccc2c(c1=O)c1ccccc1n2CCCCCCl	C25H27ClN2O	cannabinoid
+C=C1CC[C@H]2[C@H]3Cc4ccc(O)c5c4[C@@]2(CCN3C)[C@H]1O5	C18H21NO2	unknown
+COc1ccc2c3c1O[C@H]1[C@@H](OC(=O)c4cccnc4)CC[C@H]4[C@@H](C2)N(C)CC[C@@]341	C24H26N2O4	unknown
+CC[C@H](OC(C)=O)C(C[C@@H](C)N(C)C)(c1ccccc1)c1ccccc1	C23H31NO2	unknown
+CC[C@H](O)C(C[C@@H](C)N(C)C)(c1ccccc1)c1ccccc1	C21H29NO	unknown
+COc1cc(CCN)c(OC)c(Br)c1C	C11H16BrNO2	unknown
+COc1cc(CNC(=O)CCCC/C=C/C(C)C)ccc1O	C18H27NO3	unknown
+COc1ccc2c3c1O[C@H]1[C@@H](O)C=C[C@H]4[C@@H](C2)[N+](C)([O-])CC[C@@]341	C18H21NO4	unknown
+CCC(OC(C)=O)C(CC(C)NC)(c1ccccc1)c1ccccc1	C22H29NO2	unknown
+CN1CC[C@@]23CCCC[C@@H]2[C@@H]1Cc1ccc(O)cc13	C17H23NO	unknown
+CCC[C@@](C)(O)[C@H]1C[C@@]23CC[C@]1(OC)[C@@H]1Oc4c(O)ccc5c4[C@@]12CCN(C)[C@@H]3C5	C25H35NO4	unknown
+CCOC(C(=O)OCCN(C)C)(c1ccccc1)c1ccccc1	C20H25NO3	unknown
+CCOC(=O)C(CCN1CCOCC1)(c1ccccc1)c1ccccc1	C22H27NO3	unknown
+CCC(=O)C(CC(C)N1CCCCC1)(c1ccccc1)c1ccccc1	C24H31NO	unknown
+CCN(CCc1c[nH]c2ccccc12)C1CC1	C15H20N2	tryptamine
+CC(C)c1cccc(C(C)C)c1OCOP(=O)(O)O	C13H21O5P	unknown
+CCCc1nn(C)c2c(=O)nc(-c3cc(S(=O)(=O)N4CCN(CC)CC4)ccc3OCC)[nH]c12	C23H32N6O4S	unknown
+CC(=O)N(C)c1cccc(-c2ccnc3c(C(=O)c4cccs4)cnn23)c1	C20H16N4O2S	unknown
+COc1ccc2c3c1O[C@H]1[C@H](O)C=C[C@H]4[C@@H](C2)N(C)CC[C@@]341	C18H21NO3	unknown
+CNC(CC(C)C)C(=O)c1ccccc1	C13H19NO	beta-ketone
+CCC(=O)C(c1ccccc1)(c1ccccc1)C(C)CN(C)C	C21H27NO	unknown
+CC[C@H](OC(C)=O)C(C[C@H](C)N(C)C)(c1ccccc1)c1ccccc1	C23H31NO2	unknown
+C=CCN1CC[C@]23CCCC[C@H]2[C@H]1Cc1ccc(O)cc13	C19H25NO	unknown
+COc1ccc2c(c1)[C@@]13CCCC[C@H]1[C@@H](C2)N(C)CC3	C18H25NO	unknown
+C[C@@H](CN1CCOCC1)C(C(=O)N1CCCC1)(c1ccccc1)c1ccccc1	C25H32N2O2	unknown
+COc1ccccc1CNCCc1ccc(OC)c(OC)c1	C18H23NO3	unknown
+CC[C@@H]1CN2CC[C@@]3(O)C(=Nc4cc(F)cc(OC)c43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC	C23H29FN2O5	unknown
+CC[C@@H]1CN2CC[C@@]3(O)C(=Nc4cc(Cl)cc(OC)c43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC	C23H29ClN2O5	unknown
+CC[C@@H]1CN2CC[C@@]3(O)C(=Nc4cc(Br)cc(OC)c43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC	C23H29BrN2O5	unknown
+COc1ccccc1C1CCCCC1	C13H18O	unknown
+COc1cccc(C2CCCCC2)c1	C13H18O	unknown
+COc1ccc(C2CCCCC2)cc1	C13H18O	unknown
+COc1ccc2c(ccn2C[C@@H](C)N(C)C)c1	C14H20N2O	unknown
+CN(C)CCn1cc(C(=O)C(=O)N(C)C)c2ccccc21	C16H21N3O2	tryptamine
+CC(Cn1ccc2cc(F)ccc21)N(C)C	C13H17FN2	unknown
+CCNC(C)C(O)c1ccccc1F	C11H16FNO	unknown
+CCNC(C)C(O)c1cccc(F)c1	C11H16FNO	unknown
+CCNC(C)C(O)c1ccc(F)cc1	C11H16FNO	unknown
+COc1ccccc1CNCCc1cccc(OC)c1OC	C18H23NO3	unknown
+CCN(CC)CCn1c(Cc2ccc(OC(C)C)cc2)nc2cc(N)ccc21	C23H32N4O	unknown
+CCNCCn1c(Cc2ccc(OCC)cc2)nc2cc([N+](=O)[O-])ccc21	C20H24N4O3	unknown
+COc1ccccc1N1CCN([C@H](c2ccccc2)C(O)c2ccccc2)CC1	C25H28N2O2	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(c(I)n4CC)C[C@H]2N(C)C1	C22H28IN3O	unknown
+O=C(c1ccc(F)cc1)C1CCN(CCn2c(=S)[nH]c3ccccc3c2=O)CC1	C22H22FN3O2S	unknown
+CCN1CCCC1CNC(=O)c1c(O)c(Cl)cc(Cl)c1OC	C15H20Cl2N2O3	unknown
+Cc1nccc2c1[nH]c1cc(OCCF)ccc12	C14H13FN2O	unknown
+CC(=O)Nc1ccc(O)cc1	C8H9NO2	unknown
+CCOc1ccc(NC(C)=O)cc1	C10H13NO2	unknown
+O=CN1CCCCC1	C6H11NO	unknown
+O=C/C=C/c1ccc2c(c1)OCO2	C10H8O3	unknown
+C/C(=C\c1cc2c(cc1Cl)OCO2)[N+](=O)[O-]	C10H8ClNO4	unknown
+CC(=O)NC1CCCCC1	C8H15NO	unknown
+N#Cc1ccc2c(c1)OCO2	C8H5NO2	unknown
+CC(=O)Cc1cc2c(cc1Cl)OCO2	C10H9ClO3	unknown
+CC(=O)C(=O)c1ccc2c(c1)OCO2	C10H8O4	unknown
+C=C(C(C)=O)c1ccc2c(c1)OCO2	C11H10O3	unknown
+CN(C=O)Cc1ccc2c(c1)OCO2	C10H11NO3	unknown
+CN1CC1(C)Cc1ccc2c(c1)OCO2	C12H15NO2	unknown
+CC1C(c2ccc3c(c2)OCO3)OCN1C	C12H15NO3	unknown
+CC(C)(/N=C/c1ccccc1)c1ccc2c(c1)OCO2	C17H17NO2	unknown
+C(=N/Cc1ccc2c(c1)OCO2)\c1ccc2c(c1)OCO2	C16H13NO4	unknown
+[2H]C([2H])([2H])Oc1c(CCN)cccc1OC	C10H15NO2	unknown
+Nc1ccc(Br)cc1C(=O)c1ccccc1Cl	C13H9BrClNO	unknown
+O=c1nc(-c2ccccc2Cl)c2cc(Br)ccc2[nH]1	C14H8BrClN2O	unknown
+CCCCCCCC(C)(C)c1ccc([C@@H]2CCC[C@@H](O)C2)c(O)c1	C22H36O2	cannabinoid
+CCCCCCCC(C)(C)c1ccc([C@@H]2CCC[C@H](O)C2)c(O)c1	C22H36O2	cannabinoid
+CNC(Cc1ccccc1)Cc1ccccc1	C16H19N	unknown
+c1ccc2c(c1)CCNCc1ccccc1-2	C15H15N	unknown
+CC(=O)N1CCc2ccccc2-c2ccccc2C1	C17H17NO	unknown
+CN1CCc2ccccc2-c2ccccc2C1	C16H17N	unknown
+c1ccc2c(c1)CNCCc1cc3c(cc1-2)OCO3	C16H15NO2	unknown
+COc1cc2c(cc1OC)-c1ccccc1CNCC2	C17H19NO2	unknown
+COc1ccc2c(c1OC)-c1ccccc1CNCC2	C17H19NO2	unknown
+CCCc1nn(C)c2c(=S)nc(-c3cc(S(=O)(=O)N4CCNCC4)ccc3OCC)[nH]c12	C21H28N6O3S2	unknown
+CC(CN1CCOCC1)C(C(=O)N1CCCC1)(c1ccccc1)c1ccccc1	C25H32N2O2	unknown
+COc1ccc2c(c1)C13CCCCC1C(C2)N(C)CC3	C18H25NO	unknown
+CN1CCC23CCCCC2C1Cc1ccc(O)cc13	C17H23NO	unknown
+O=C(Oc1cccc2cccnc12)c1nn(Cc2ccccc2)c2ccccc12	C24H17N3O2	cannabinoid
+O=C(Oc1cccc2cccnc12)c1c[nH]c2ccccc12	C18H12N2O2	cannabinoid
+CC(F)CCCn1nc(C(=O)Oc2cccc3cccnc23)c2ccccc21	C22H20FN3O2	cannabinoid
+CCCC(F)Cn1nc(C(=O)Oc2cccc3cccnc23)c2ccccc21	C22H20FN3O2	cannabinoid
+C1=Cc2ccccc2/C1=C/c1cccc2ccccc12	C20H14	cannabinoid
+CCCCCC(NCC)C(=O)c1ccc2c(c1)OCO2	C16H23NO3	beta-ketone
+C1=Cc2ccccc2/C1=C/c1ccc2ccccc2c1	C20H14	cannabinoid
+C1=CC(Cc2ccc3ccccc3c2)c2ccccc21	C20H16	cannabinoid
+CC(Cc1ccccc1F)N1CCCC1	C13H18FN	unknown
+CNC(C)Cc1coc2ccccc12	C12H15NO	unknown
+CNC(C)C(c1ccccc1)c1ccccc1	C16H19N	unknown
+CCCc1nn(C)c2c(=O)nc(-c3cc(S(=O)(=O)N4C[C@@H](C)N[C@@H](C)C4)ccc3OCC)[nH]c12	C23H32N6O4S	unknown
+CCC(N)C(=O)c1ccccc1	C10H13NO	beta-ketone
+CNC(C)C(C)(O)c1ccccc1	C11H17NO	unknown
+CC[C@@H](OC(C)=O)C(C[C@H](C)N(C)C)(c1ccccc1)c1ccccc1.CC[C@H](OC(C)=O)C(C[C@@H](C)N(C)C)(c1ccccc1)c1ccccc1	2C23H31NO2	unknown
+CC[C@@H](O)C(C[C@@H](C)N(C)C)(c1ccccc1)c1ccccc1	C21H29NO	unknown
+O=C(CN1CC[C@]23CCCC[C@H]2[C@H]1Cc1ccc(O)cc13)c1ccccc1	C24H27NO2	unknown
+CN1CC[C@]23CCCC[C@H]2[C@H]1Cc1ccc(O)cc13	C17H23NO	unknown
+O=C(Nc1cccc2cccnc12)c1nn(Cc2ccccc2)c2ccccc12	C24H18N4O	cannabinoid
+O=C(Nc1cccc2cccnc12)c1cn(Cc2ccccc2)c2ccccc12	C25H19N3O	cannabinoid
+CN1CCNCC1Cc1ccccc1	C12H18N2	unknown
+CC(=NO)C(=O)c1ccccc1	C9H9NO2	unknown
+O=C(c1c[nH]c2ccccc12)C1C2CC3CC(C2)CC1C3	C19H21NO	cannabinoid
+O=C(c1ccc2ccccc2c1)c1c[nH]c2ccccc12	C19H13NO	cannabinoid
+O=C(c1cc[nH]c1)c1ccc2ccccc2c1	C15H11NO	cannabinoid
+c1ccc(Cc2nnc(-c3cn(CCN4CCOCC4)c4ccccc34)o2)cc1	C23H24N4O2	cannabinoid
+c1ccc(Cc2nnc(-c3cn(CCN4CCCC4)c4ccccc34)o2)cc1	C23H24N4O	cannabinoid
+O=C(c1ccccc1)c1c[nH]c2ccccc12	C15H11NO	cannabinoid
+NC(=O)c1n[nH]c2ccccc12	C8H7N3O	unknown
+NC(=O)c1c[nH]c2ccccc12	C9H8N2O	unknown
+CN1CC[C@]23c4c5ccc(OCC(=O)O)c4O[C@H]2[C@@H](O)C=C[C@H]3[C@H]1C5	C19H21NO5	unknown
+O=C(Cc1ccccc1)c1c[nH]c2ccccc12	C16H13NO	unknown
+CCC(F)CCn1cc(C(=O)Nc2cccc3ccccc23)c2ccccc21	C24H23FN2O	cannabinoid
+CCN(CCc1c[nH]c2cccc(OC(C)=O)c12)C(C)C	C17H24N2O2	tryptamine
+CCN(CC)CC(C)(C)COC(=O)c1ccc(F)cc1	C16H24FNO2	unknown
+COc1ccc2c(c1OC)-c1ccccc1CCNC2	C17H19NO2	unknown
+Ic1ccccc1CCNCc1ccccc1I	C15H15I2N	unknown
+Ic1cccc2c1CCNCc1ccccc1-2	C15H14IN	unknown
+CC(=O)N1CCc2c(I)cccc2-c2ccccc2C1	C17H16INO	unknown
+CN1CCc2c(I)cccc2-c2ccccc2C1	C16H16IN	unknown
+Ic1cccc2c1CNCCc1ccccc1-2	C15H14IN	unknown
+CC(=O)N1CCc2ccccc2-c2cccc(I)c2C1	C17H16INO	unknown
+CN1CCc2ccccc2-c2cccc(I)c2C1	C16H16IN	unknown
+OC(CNCc1ccccc1)c1ccccc1I	C15H16INO	unknown
+Ic1ccccc1CNCCc1ccccc1	C15H16IN	unknown
+O=Cc1ccccc1I	C7H5IO	unknown
+Ic1ccccc1CCNCc1ccccc1	C15H16IN	unknown
+Ic1cc2c(cc1CCNCc1ccccc1)OCO2	C16H16INO2	unknown
+COc1cc(I)c(CCNCc2ccccc2)cc1OC	C17H20INO2	unknown
+Brc1cc2c(cc1CCNCc1ccccc1)OCO2	C16H16BrNO2	unknown
+COc1cc(Br)c(CCNCc2ccccc2)cc1OC	C17H20BrNO2	unknown
+Ic1cc2c(cc1CNCCc1ccccc1)OCO2	C16H16INO2	unknown
+COc1cc(I)c(CNCCc2ccccc2)cc1OC	C17H20INO2	unknown
+Brc1cc2c(cc1CNCCc1ccccc1)OCO2	C16H16BrNO2	unknown
+COc1cc(Br)c(CNCCc2ccccc2)cc1OC	C17H20BrNO2	unknown
+COc1ccc2c(c1OC)-c1ccccc1CCN(C)C2	C18H21NO2	unknown
+COc1ccc2c(c1O)-c1ccccc1CCN(C)C2	C17H19NO2	unknown
+COc1ccc(CNCCc2ccccc2)c(Br)c1OC	C17H20BrNO2	unknown
+c1ccc(CNCCc2cccc3c2OCO3)cc1	C16H17NO2	unknown
+COc1cccc(CCNCc2ccccc2)c1OC	C17H21NO2	unknown
+OC(CNCc1ccccc1)c1ccccc1	C15H17NO	unknown
+COc1ccc(C=O)c(Br)c1OC	C9H9BrO3	unknown
+CN(C)Cc1c[nH]c2ccccc12	C11H14N2	unknown
+CCc1ccc2[nH]cc(CN(C)C)c2c1	C13H18N2	unknown
+COc1ccc2[nH]cc(CN(C)C)c2c1	C12H16N2O	unknown
+CC(C)ON=O	C3H7NO2	unknown
+CCCCON=O	C4H9NO2	unknown
+CC(C)CON=O	C4H9NO2	unknown
+CC(C)(C)ON=O	C4H9NO2	unknown
+CC(C)CCON=O	C5H11NO2	unknown
+O=NOC1CCCCC1	C6H11NO2	unknown
+FC(F)(F)C(Cl)Br	C2HBrClF3	unknown
+C=COCC(F)(F)F	C4H5F3O	unknown
+COC(F)(F)C(Cl)Cl	C3H4Cl2F2O	unknown
+FC(F)OC(F)(F)C(F)Cl	C3H2ClF5O	unknown
+FC(F)OC(Cl)C(F)(F)F	C3H2ClF5O	unknown
+FC(F)OC(F)C(F)(F)F	C3H2F6O	unknown
+FCOC(C(F)(F)F)C(F)(F)F	C4H3F7O	unknown
+CCCC(C)C1(CC)C(=O)NC(=S)NC1=O	C11H18N2O2S	unknown
+C=CCC1(C(C)C#CCC)C(=O)NC(=O)N(C)C1=O	C14H18N2O3	unknown
+O=c1[nH]c2ccccc2c(=O)n1CCNCc1ccccc1	C17H17N3O2	unknown
+O=c1[nH]c2ccccc2c(=O)n1CCNCc1cccs1	C15H15N3O2S	unknown
+O=c1[nH]c2ccccc2c(=O)n1CCNCc1ccccc1Cl	C17H16ClN3O2	unknown
+O=c1[nH]c2ccccc2c(=O)n1CCNCc1ccccc1Br	C17H16BrN3O2	unknown
+Cc1ccccc1CNCCn1c(=O)[nH]c2ccccc2c1=O	C18H19N3O2	unknown
+CCOc1ccccc1CNCCn1c(=O)[nH]c2ccccc2c1=O	C19H21N3O3	unknown
+Nc1ccccc1CNCCn1c(=O)[nH]c2ccccc2c1=O	C17H18N4O2	unknown
+O=C(c1c[nH]c2ccccc12)C1CC1	C12H11NO	unknown
+CCC(OC(C)=O)C(CC(C)N(C)C)(c1ccccc1)c1ccccc1	C23H31NO2	unknown
+COc1cc(C(=O)CBr)c(OC)cc1Br	C10H10Br2O3	unknown
+COc1ccc2c(c1)-c1ccccc1CNCC2	C16H17NO	unknown
+c1ccc2c(c1)CCNCc1cc3c(cc1-2)OCO3	C16H15NO2	unknown
+COc1cc2c(cc1OC)-c1ccccc1CCNC2	C17H19NO2	unknown
+O=c1[nH]c2ccccc2c(=O)n1CCNCc1ccccc1O	C17H17N3O3	unknown
+COc1cc(C(C)O)c(OC)cc1Br	C10H13BrO3	unknown
+CC(C)(NC(=O)c1ccc2c(c1)c1ccccc1n2CCCCC#N)c1ccccc1	C27H27N3O	cannabinoid
+CC(NCc1ccccc1)C(=O)c1ccc(N(C)C)cc1	C18H22N2O	beta-ketone
+CCCCC(C)NC(C)Cc1ccc(OC)c(OC)c1	C17H29NO2	unknown
+COC(=O)[C@@H](NC(=O)c1cn(CC2CCCCC2)c2ncccc12)C(C)(C)C	C22H31N3O3	cannabinoid
+CC(C)(C)OC(=O)NC1(c2ccccc2Cl)CCCCC1=O	C17H22ClNO3	arylcycloalkylamine
+CCCCC(NC(C)C)C(=O)c1ccc2c(c1)OCO2	C16H23NO3	beta-ketone
+CCCCNc1ccc(C(=O)OCCN(C)C)cc1	C15H24N2O2	unknown
+CC(C)N(C(=O)c1ccc(F)c(F)c1)[C@@H]1CCCC[C@H]1N(C)C	C18H26F2N2O	unknown
+CCCN(C(=O)c1ccc(F)c(F)c1)[C@@H]1CCCC[C@H]1N(C)C	C18H26F2N2O	unknown
+CN(C(=O)Cc1ccc(F)c(F)c1)[C@@H]1CCCC[C@H]1N1CCCC1	C19H26F2N2O	unknown
+CN(C)[C@@H]1CCCC[C@H]1N(C)C(=O)Cc1ccc(F)cc1F	C17H24F2N2O	unknown
+Cc1cccc(C)c1NC1=NCCCS1	C12H16N2S	unknown
+c1ccc(CCN2CCC(N(CCc3ccccc3)c3ccccc3)CC2)cc1	C27H32N2	fentanyl
+CC(C)(C)OC(=O)N1CCC(Nc2ccccc2)CC1	C16H24N2O2	unknown
+COC(=O)[C@@H](NC(=O)c1c2ccccc2nn1CCCCCF)C(C)(C)C	C20H28FN3O3	unknown
+NC1(c2ccccc2F)CCCCC1=O	C12H14FNO	arylcycloalkylamine
+CCCC(C(=O)c1ccc(OCC)c(OC)c1)N(CC)CC	C18H29NO3	beta-ketone
+CCCCC(C(=O)c1ccc(OCC)c(OC)c1)N(CC)CC	C19H31NO3	beta-ketone
+C=CCCn1nc(C(=O)N[C@H](C(=O)OC)C(C)(C)C)c2ccccc21	C19H25N3O3	cannabinoid
+Cc1ccc(N(C(=O)c2ccccc2)C2CCN(C)CC2)cc1	C20H24N2O	fentanyl
+CCCC(C(=O)c1ccc(OC)c(OCC)c1)N(CC)CC	C18H29NO3	beta-ketone
+Cc1cccc(N(C(=O)c2ccccc2)C2CCN(C)CC2)c1	C20H24N2O	fentanyl
+Cc1ccccc1N(C(=O)c1ccccc1)C1CCN(C)CC1	C20H24N2O	fentanyl
+CCCC(C(=O)c1ccc2c(c1)OCO2)N(C)CCC	C16H23NO3	beta-ketone
+CCCC(C(=O)c1cc(OC)c2c(c1)OCO2)N(CC)CC	C17H25NO4	beta-ketone
+CC(C)N[C@@H]1CCn2c(=O)[nH]c3cccc(c32)[C@H]1O	C14H19N3O2	unknown
+COC(CN1CCN(CC(O)C(OC)c2ccccc2)CC1)c1ccccc1	C23H32N2O3	unknown
+CCOC(=O)C1=C[C@]2(CC)CCCN3CCc4c(n1c1ccccc41)[C@@H]32	C22H26N2O2	unknown
+CCNC(CC)C(=O)c1cccc(F)c1	C12H16FNO	beta-ketone
+C=CCCCn1nc(C(=O)N[C@@H](CC)C(N)=O)c2ccccc21	C17H22N4O2	cannabinoid
+Cc1ccc2[nH]cc(CCN(C)C)c2c1O	C13H18N2O	tryptamine
+CC1=CC(=O)C2NC=C(CCN(C)C)C2C1=O	C13H18N2O2	unknown
+Cc1ccc(O)c2c(CCN(C)C)c[nH]c12	C13H18N2O	tryptamine
+CC(=O)Oc1c(C)ccc2[nH]ccc12	C11H11NO2	unknown
+CC(=O)Oc1ccc(C)c2[nH]ccc12	C11H11NO2	unknown
+CC(=O)Oc1ccc2[nH]ccc2c1	C10H9NO2	unknown
+CC(=O)Oc1c(-c2cc(C)c3[nH]cc(CCN(C)C)c3c2OC(C)=O)cc(C)c2[nH]cc(CCN(C)C)c12	C30H38N4O4	unknown
+CC(=O)Oc1c(C)ccc2[nH]cc(C(=O)C(=O)N(C)C)c12	C15H16N2O4	tryptamine
+CC(=O)Oc1ccc(C)c2[nH]cc(C(=O)C(=O)N(C)C)c12	C15H16N2O4	tryptamine
+CC(=O)Oc1ccc2[nH]cc(C(=O)C(=O)N(C)C)c2c1	C14H14N2O4	tryptamine
+CN(C)CCc1c[nH]c2ccc(O)c(-c3c(O)ccc4[nH]cc(CCN(C)C)c34)c12	C24H30N4O2	unknown
+CC1=CC(=O)c2[nH]cc(CCN(C)C)c2C1=O	C13H16N2O2	unknown
+COc1ccc2[nH]cc(CC[N+](C)(C)C(C)(C)Cl)c2c1	C16H24ClN2O	tryptamine
+CN(C)CCc1c[nH]c2c1C(=O)C=CC2=C1C=CC(=O)c2c(CCN(C)C)c[nH]c21	C24H28N4O2	unknown
+CC1=CC(=C2C=C(C)C(=O)c3c(CCN(C)C)c[nH]c32)c2[nH]cc(CCN(C)C)c2C1=O	C26H32N4O2	unknown
+CN(C)CCc1c[nH]c2c1C(=O)C(=C1C=CC(=O)c3c(CCN(C)C)c[nH]c31)C=C2	C24H28N4O2	unknown
+CC1=CC(=C2C=C(C)c3[nH]cc(CCN(C)C)c3C2=O)c2[nH]cc(CCN(C)C)c2C1=O	C26H32N4O2	unknown
+COc1cc(C)c(OC)c(C=O)c1C	C11H14O3	unknown
+COc1cc(C)c(C)c(C=O)c1OC	C11H14O3	unknown
+CCOc1cc(OC)c(OCC)cc1C=O	C12H16O4	unknown
+CC(C)(C)[C@H](NC(=O)Cc1cn(Cc2ccc(F)cc2)c2ccccc12)C(N)=O	C23H26FN3O2	cannabinoid
+CCCCCCC(=O)N(c1ccccc1)C1CCN(CCc2ccccc2)CC1	C26H36N2O	fentanyl
+CNC(C)Cc1ccc2sccc2c1	C12H15NS	unknown
+CNC(C)Cc1cccc2sccc12	C12H15NS	unknown
+CNC(C)Cc1ccc2ccsc2c1	C12H15NS	unknown
+CNC(C)Cc1csc2ccccc12	C12H15NS	unknown
+CNC(C)Cc1cc2ccccc2s1	C12H15NS	unknown
+CNC(C)Cc1cccc2ccsc12	C12H15NS	unknown
+CC(C=O)Cc1ccc2c(c1)OCO2	C11H12O3	unknown
+CCCC(CC)C1(CC)C(=O)NC(=O)NC1=O	C12H20N2O3	unknown
+Clc1ccccc1NC1CCN(CCc2ccccc2)CC1	C19H23ClN2	unknown
+Clc1cccc(NC2CCN(CCc3ccccc3)CC2)c1	C19H23ClN2	unknown
+Clc1ccc(NC2CCN(CCc3ccccc3)CC2)cc1	C19H23ClN2	unknown
+COc1ccc2c3c1O[C@H]1[C@@H](OC(C)=O)C=C[C@H]4[C@@H](C2)N(C)CC[C@@]341	C20H23NO4	unknown
+C/C=C\C(=O)N(c1ccccc1)C1CCN(CCc2ccccc2)CC1	C23H28N2O	unknown
+CNC1(c2cccc(F)c2)CCCCC1=O	C13H16FNO	unknown
+CNC1(c2ccc(F)cc2)CCCCC1=O	C13H16FNO	unknown
+CC(N)C(=O)c1cccc(Cl)c1	C9H10ClNO	beta-ketone
+CCN1/C(=C/c2ccc3ccccc3[n+]2CC)C=Cc2ccccc21	C23H23N2	unknown
+CCc1cc(OC)c(C=O)cc1OC	C11H14O3	unknown
+COc1cc(C=O)c(OC)cc1Cl	C9H9ClO3	unknown
+COc1cc(CCN)cc(OC)c1OC1C=CCC1	C15H21NO3	unknown
+COc1cc(CCN)cc(OC)c1OC1CC=CC1	C15H21NO3	unknown
+COCOc1c(OC)cc(CCN)cc1OC	C12H19NO4	unknown
+COc1cc(CCN)cc(OC)c1OC(C)C(F)F	C13H19F2NO3	unknown
+C=C(F)COc1c(OC)cc(CCN)cc1OC	C13H18FNO3	unknown
+NCCc1ccc(C(F)(F)F)c2c1OCCO2	C11H12F3NO2	unknown
+COc1cc2c(cc1C(CN)SC)OCO2	C11H15NO3S	unknown
+CCCCCn1cc(C(=O)N[C@H](C(=O)OC)C(C)C)c2cccnc21	C19H27N3O3	cannabinoid
+CCCCCn1cc(C(=O)N[C@H](C(N)=O)C(C)(C)C)c2cccnc21	C19H28N4O2	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1nn(CC2CCOCC2)c2ncccc12)C(N)=O	C19H27N5O3	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1nn(CC2CCCCC2)c2ncccc12)C(N)=O	C20H29N5O2	cannabinoid
+O=C(N[C@H]1CCCc2ccccc21)c1nn(CC2CCCCC2)c2ncccc12	C24H28N4O	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1nn(CCCCC#N)c2ncccc12)C(N)=O	C18H24N6O2	cannabinoid
+CCCCCn1nc(C(=O)NC23CC4CC(CC(C4)C2)C3)c2cccnc21	C22H30N4O	cannabinoid
+CCCCCn1nc(C(=O)N[C@H](C(=O)OC)C(C)(C)C)c2ncccc21	C19H28N4O3	cannabinoid
+CCCCCn1nc(C(=O)N[C@H](C(=O)OC)C(C)(C)C)c2cnccc21	C19H28N4O3	cannabinoid
+CCCCCn1nc(C(=O)N[C@H](C(=O)OC)C(C)(C)C)c2ccncc21	C19H28N4O3	cannabinoid
+CCCCCn1nc(C(=O)N[C@H](C(=O)OC)C(C)(C)C)c2cccnc21	C19H28N4O3	cannabinoid
+CNC(COC)C(=O)c1ccc(CO)cc1	C12H17NO3	beta-ketone
+CNC(CO)C(=O)c1ccc(C)cc1	C11H15NO2	beta-ketone
+COCC(N)C(=O)c1ccc(C)cc1	C11H15NO2	beta-ketone
+CN(C)CCn1c(Cc2ccc(Cl)cc2)nc2ccccc21	C18H20ClN3	unknown
+CCN(CC)CCn1c(Cc2ccc(Cl)cc2)nc2ccccc21	C20H24ClN3	unknown
+CCN(CC)CCn1c(Cc2ccc(Cl)cc2)nc2ccc([N+](=O)[O-])cc21	C20H23ClN4O2	unknown
+CCN(CC)CCn1c(Cc2ccccc2)nc2ccc(N)cc21	C20H26N4	unknown
+CN(C)CCn1c(Cc2ccc(Cl)cc2)nc2cc([N+](=O)[O-])ccc21	C18H19ClN4O2	unknown
+CCN(CC)CCn1c(C(C)c2ccc(OC)cc2)nc2ccccc21	C22H29N3O	unknown
+CCOc1ccc(C(C(N)=O)c2nc3cc([N+](=O)[O-])ccc3n2CCN(CC)CC)cc1	C23H29N5O4	unknown
+CCOc1ccc(Cc2nc3cc(C#N)ccc3n2CCN(CC)CC)cc1	C23H28N4O	unknown
+CCN(CC)CCn1c(Cc2ccc(OC)cc2)nc2cc(C(F)(F)F)ccc21	C22H26F3N3O	unknown
+CCOc1ccc(Cc2nc3cc(C(F)(F)F)ccc3n2CCN(CC)CC)cc1	C23H28F3N3O	unknown
+CCOC(=O)C(c1ccc(OCC)cc1)c1nc2cc(C(C)=O)ccc2n1CCN(CC)CC	C27H35N3O4	unknown
+CCN(CC)CCn1c(Sc2ccc(C(C)C)cc2)nc2ccccc21	C22H29N3S	unknown
+CCCOc1ccc(Sc2nc3ccccc3n2CCN(CC)CC)cc1	C22H29N3OS	unknown
+CCNc1ccc(Sc2nc3ccccc3n2CCN(CC)CC)cc1	C21H28N4S	unknown
+CCOc1ccc(OCc2nc3ccccc3n2CCN(CC)CC)cc1	C22H29N3O2	unknown
+CCOc1ccc(OCc2nc3cc(C)ccc3n2CCN(CC)CC)cc1	C23H31N3O2	unknown
+CCOc1ccc(OCc2nc3cc([N+](=O)[O-])ccc3n2CCN(CC)CC)cc1	C22H28N4O4	unknown
+Fc1ccc(-c2nc3ccccc3n2CCN2CCCCC2)cc1	C20H22FN3	unknown
+CCOc1ccc(-c2nc3ccccc3n2CCN2CCCCC2)cc1	C22H27N3O	unknown
+c1ccc(Cn2c(-c3ccccc3)nc3ccccc32)cc1	C20H16N2	unknown
+Clc1cc2nc(-c3ccccc3)n(Cc3ccccc3)c2cc1Cl	C20H14Cl2N2	unknown
+CCN(CC)CCn1c(CCN2CCOCC2)nc2cc([N+](=O)[O-])ccc21	C19H29N5O3	unknown
+CN(C)CCCn1c(CCN2CCCC2)nc2cc([N+](=O)[O-])ccc21	C18H27N5O2	unknown
+CN(C)CCCn1c(CCN2CCOCC2)nc2cc([N+](=O)[O-])ccc21	C18H27N5O3	unknown
+Cc1ccc(CC2=C(CCN(C)C)c3ccccc3C2)cc1	C21H25N	unknown
+CN(C)CCC1=C(Cc2ccc(Cl)cc2)Cc2ccccc21	C20H22ClN	unknown
+CN(C)CCC1=C(Cc2ccc(F)cc2)Cc2ccccc21	C20H22FN	unknown
+CCN(CC)CCC1=C(Cc2ccccc2)Cc2ccccc21	C22H27N	unknown
+c1ccc(CC2=C(CCN3CCCC3)c3ccccc3C2)cc1	C22H25N	unknown
+CCN(CC)CCc1c(-c2ccccc2)[nH]c2ccccc12	C20H24N2	tryptamine
+CCN(CC)CCc1c(-c2ccc(C)cc2)[nH]c2ccccc12	C21H26N2	tryptamine
+CCN(CC)CCc1c(-c2ccc(OC)cc2)[nH]c2ccccc12	C21H26N2O	tryptamine
+CN(C)CCN(C(=O)Cc1ccc(Cl)cc1)c1ccccc1	C18H21ClN2O	unknown
+CN(C)CCN(C(=O)Cc1ccc(Cl)cc1)c1ccc([N+](=O)[O-])cc1	C18H20ClN3O3	unknown
+CCOc1ccc(Cc2nc3cc([N+](=O)[O-])ccc3n2CCC2CCCN2C)cc1	C23H28N4O3	unknown
+CCOc1ccc(Cc2nc3cc(NC(=N)c4cccs4)ccc3n2CCN(CC)CC)cc1	C27H33N5OS	unknown
+CCOc1ccc(Cc2nc3cc(C(=O)N(CC)CC)ccc3n2CCN(CC)CC)cc1	C27H38N4O2	unknown
+CCOc1ccc(Cc2nc3cc(C(=O)N(CC)CC)ccc3n2CC2CCC2)cc1	C26H33N3O2	unknown
+CCOc1ccc(Nc2nc3cc(C(=O)N(CC)CC)ccc3n2CCC(C)C)cc1	C25H34N4O2	unknown
+CCOc1ccc(Cc2nc3cc(C(=O)N(CC)CC)ccc3n2CCC(C)C)cc1	C26H35N3O2	unknown
+CCOc1ccc(Cc2nc3cc(C(=O)N(CC)CC)ccc3n2CCN2CCCCC2)cc1	C28H38N4O2	unknown
+CN1CCN(c2cccc3[nH]c(Cc4cccc5ccccc45)nc23)CC1	C23H24N4	unknown
+CN1CCN(c2cccc3[nH]c(C(=O)c4cccc5ccccc45)nc23)CC1	C23H22N4O	unknown
+CCC(=O)n1c(=O)n(C2CCN(CCC(C(=O)CC)(c3ccccc3)c3ccccc3)CC2)c2ccccc21	C33H37N3O3	unknown
+CCCN[C@H]1CCc2nc(N)sc2C1	C10H17N3S	unknown
+CN1CCC=C(C(=O)O)C1	C7H11NO2	unknown
+COC(=O)C1=CCCNC1	C7H11NO2	unknown
+O=C(O)C1=CCCNC1	C6H9NO2	unknown
+CC1CN(CCCc2ccccc2)[C@H]2C[C@@H](NC(=O)C(C)(C)c3ccccc3)C[C@@]1(c1cccc(O)c1)C2	C34H42N2O2	unknown
+COC(=O)/C=C/C(=O)N[C@@H]1CC[C@@]2(O)[C@H]3Cc4ccc(O)c5c4[C@@]2(CCN3CC2CC2)[C@H]1O5	C25H30N2O6	unknown
+Oc1ccc2c3c1O[C@H]1c4ncc(-c5ccc(Cl)cc5)cc4C[C@@]4(O)[C@@H](C2)N(CC2CC2)CC[C@]314	C29H27ClN2O3	unknown
+CN1CC[C@]23c4c5ccc(O)c4O[C@H]2C(=O)/C(=C/c2ccccc2)C[C@@]3(O)[C@H]1C5	C24H23NO4	unknown
+CC(Cc1ccc2c(c1)OCO2)NC(C)c1ccccc1	C18H21NO2	unknown
+CC(=O)Cc1ccc(OCc2ccccc2)c(OCc2ccccc2)c1	C23H22O3	unknown
+CC(Cc1ccc(OCc2ccccc2)c(OCc2ccccc2)c1)NS(=O)C(C)(C)C	C27H33NO3S	unknown
+CCOC(=O)NC(C)Cc1ccc(OCc2ccccc2)c(OCc2ccccc2)c1	C26H29NO4	unknown
+COC(=O)NC(C)Cc1ccc(O)c(O)c1	C11H15NO4	unknown
+COC(=O)NC(C)Cc1ccc2c(c1)OCO2	C12H15NO4	unknown
+Cc1ccc(S(=O)(=O)NC(C)Cc2ccc3c(c2)OCO3)cc1	C17H19NO4S	unknown
+Cc1ccc(S(=O)(=O)N(C)C(C)Cc2ccc3c(c2)OCO3)cc1	C18H21NO4S	unknown
+Cc1ncncc1-c1ccccc1	C11H10N2	unknown
+c1ccc(Cc2cncnc2)cc1	C11H10N2	unknown
+C/C(=C/c1ccccc1)Cc1ccccc1	C16H16	unknown
+C/C(=C\c1ccccc1)Cc1ccccc1	C16H16	unknown
+CC(Cc1ccccc1)/N=C/c1ccccc1	C16H17N	unknown
+O=C(Cc1ccccc1)Cc1ccccc1	C15H14O	unknown
+CC(=O)O/C(C)=C/c1ccccc1	C11H12O2	unknown
+CC(=O)O/C(C)=C\c1ccccc1	C11H12O2	unknown
+CC(=O)O/C(=C/c1ccccc1)Cc1ccccc1	C17H16O2	unknown
+COC(=O)[C@@H]1C2CCC(C[C@@H]1O)N2C(=O)c1ccccc1	C16H19NO4	unknown
+COC(=O)[C@@H]1C2CCC(C[C@@H]1OC(=O)c1ccccc1)N2C=O	C17H19NO5	unknown
+C=[N+]1C2CCC1[C@@H](C(=O)OC)[C@@H](OC(=O)c1ccccc1)C2	C17H20NO4	unknown
+C=CCC1(CC=C)C(=O)NC(=O)NC1=O	C10H12N2O3	unknown
+C=CCC1(C(C)C)C(=O)NC(=O)NC1=O	C10H14N2O3	unknown
+CN(CC#N)CCc1ccccc1	C11H14N2	unknown
+CCN(CC#N)Cc1ccccc1	C11H14N2	unknown
+CCC(=O)N(C)C(C)Cc1ccccc1	C13H19NO	unknown
+CC(=O)Oc1ccc2c3c1O[C@H]1[C@@H](OC(C)=O)C=C[C@H]4[C@@H](C2)N(C(C)=O)CC[C@@]341	C22H23NO6	unknown
+CC(=O)O[C@H]1C=C[C@H]2[C@H]3Cc4ccc(O)c5c4[C@@]2(CCN3C(C)=O)[C@H]1O5	C20H21NO5	unknown
+CNC1=C(C(=O)OC)C2CCC(C1)N2C	C11H18N2O2	unknown
+COC(=O)C1=C(OC(=O)c2ccccc2)CC2CCC1N2C	C17H19NO4	unknown
+CN1C2C=C(OC(=O)c3ccccc3)CC1CC2	C15H17NO2	unknown
+CC(C)(N)c1ccccc1	C9H13N	unknown
+CN(C)Cc1ccccc1	C9H13N	unknown
+CCCNc1ccccc1	C9H13N	unknown
+CC(C)Nc1ccccc1	C9H13N	unknown
+CCN(C)c1ccccc1	C9H13N	unknown
+Cc1nc2ccccc2c(=O)n1-c1ccccc1	C15H12N2O	unknown
+Cc1cccc(-n2c(C)nc3ccccc3c2=O)c1	C16H14N2O	unknown
+Cc1ccc(-n2c(C)nc3ccccc3c2=O)cc1	C16H14N2O	unknown
+Cc1nc2ccccc2c(=O)n1-c1ccccc1F	C15H11FN2O	unknown
+Cc1nc2ccccc2c(=O)n1-c1cccc(F)c1	C15H11FN2O	unknown
+Cc1nc2ccccc2c(=O)n1-c1ccc(F)cc1	C15H11FN2O	unknown
+Cc1nc2ccccc2c(=O)n1-c1cccc(Cl)c1	C15H11ClN2O	unknown
+Cc1nc2ccccc2c(=O)n1-c1ccc(Cl)cc1	C15H11ClN2O	unknown
+Cc1nc2ccccc2c(=O)n1-c1cccc(Br)c1	C15H11BrN2O	unknown
+Cc1nc2ccccc2c(=O)n1-c1ccc(Br)cc1	C15H11BrN2O	unknown
+Cc1nc2ccccc2c(=O)n1-c1ccccc1I	C15H11IN2O	unknown
+Cc1nc2ccccc2c(=O)n1-c1cccc(I)c1	C15H11IN2O	unknown
+Cc1nc2ccccc2c(=O)n1-c1ccc(I)cc1	C15H11IN2O	unknown
+CCOC(=O)[C@@H]1C2CCC(C[C@@H]1O)N2C	C11H19NO3	unknown
+CN1C2CCC1[C@@H](C(=O)O)[C@@H](OC(=O)/C=C\c1ccccc1)C2	C18H21NO4	unknown
+CN(CCc1ccccc1)CCc1ccccc1	C17H21N	unknown
+c1ccc(Cc2ccncn2)cc1	C11H10N2	unknown
+Cc1cc(Cc2ccccc2)ncc1-c1ccccc1	C19H17N	unknown
+Cc1ncc(-c2ccccc2)c(C)c1-c1ccccc1	C19H17N	unknown
+Cc1cc(Cc2ccccc2)nc(C)c1-c1ccccc1	C20H19N	unknown
+Cc1nc(Cc2ccccc2)ccc1-c1ccccc1	C19H17N	unknown
+Cc1nc(C)c(-c2ccccc2)cc1-c1ccccc1	C19H17N	unknown
+CC1(Cc2ccccc2)CC(=O)C(c2ccccc2)=CN1	C19H19NO	unknown
+CCN1CCCC1COC(=O)C(O)(c1ccccc1)C1CCCC1	C20H29NO3	unknown
+O=C(OC1CCCN(C/C=C/c2ccccc2)C1)C(O)(c1ccccc1)c1ccccc1	C28H29NO3	unknown
+O=C(OC1CCNCC1)C(O)(c1ccccc1)c1ccccc1	C19H21NO3	unknown
+C[N+](C)(C)CCc1ccccc1	C11H18N	unknown
+COc1cccc(C(O)CN)c1	C9H13NO2	unknown
+CCOC(CNC)c1ccc(O)cc1	C11H17NO2	unknown
+COc1cc(CCNC(C)=O)ccc1O	C11H15NO3	unknown
+COc1cc(C(O)CN(C)C)ccc1O	C11H17NO3	unknown
+COc1cc2c(c(O)c1OC)C=NCC2	C11H13NO3	unknown
+COc1cc2c(c(O)c1OC)C(C)=NCC2	C12H15NO3	unknown
+COc1cc2c(c(O)c1OC)CCN(C)C2CO	C13H19NO4	unknown
+COc1cc2c(c(O)c1OC)CC[N+](C)([O-])C2CO	C13H19NO5	unknown
+COc1cc2c(c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c1OC)CCN(C)C2CO	C19H29NO9	unknown
+COc1cc2c(c(OC)c1OC)C(C(=O)O)NCC2	C13H17NO5	unknown
+COc1cc2c(c(OC)c1OC)C(C)(C(=O)O)NCC2	C14H19NO5	unknown
+COc1c2c(c(OC)c(OC)c1OC)CNCC2	C13H19NO4	unknown
+COc1c(OC)c(OC)c2cnccc2c1OC	C13H15NO4	unknown
+COc1c2c(c(OC)c(OC)c1OC)C(C)NCC2	C14H21NO4	unknown
+COc1c2c(c(OC)c(OC)c1OC)C(C)=NCC2	C14H19NO4	unknown
+COc1c(OC)c(OC)c2c(C)nccc2c1OC	C14H17NO4	unknown
+COc1c2c(c(OC)c(OC)c1OC)C(C)N(C)CC2	C15H23NO4	unknown
+COc1cc2c(cc1Oc1c(Oc3c(O)c(OC)cc4c3C(CC(C)C)N(C)CC4)c(OC)cc3c1C(CC(C)C)N(C)CC3)C(CC(C)C)N(C)CC2	C45H65N3O6	unknown
+COc1cc2c3c4c1OC1(CC(C)C)c5c(cc(OC)c(c5-4)OC3(CC(C)C)N(C)CC2)CCN1C	C30H40N2O4	unknown
+CC(C)CC(=O)NCCc1c[nH]cn1	C10H17N3O	unknown
+CN(C)CCc1c[nH]cn1	C7H13N3	unknown
+CNCC(O)c1ccc(OC)cc1	C10H15NO2	unknown
+COc1ccc(C(O)CN(C)C)cc1	C11H17NO2	unknown
+CN1Cc2c(O)cccc2C(O)C1	C10H13NO2	unknown
+c1cncc([C@@H]2CCCN2)c1	C9H12N2	unknown
+COc1cc2ccncc2cc1OC	C11H11NO2	unknown
+COc1ccc2c(c1OC)CNCC2	C11H15NO2	unknown
+COc1ccc2c(c1OC)C=NCC2	C11H13NO2	unknown
+COc1ccc2ccncc2c1OC	C11H11NO2	unknown
+COc1cc2c(cc1O)CN(C)CC2	C11H15NO2	unknown
+COc1cc2c(cc1O)C(C)NCC2	C11H15NO2	unknown
+COc1cc2ccnc(C)c2cc1OC	C12H13NO2	unknown
+COc1cc2cc[n+](C)cc2cc1OC	C12H14NO2	unknown
+COc1cc2c(cc1O)C(C)N(C)CC2	C12H17NO2	unknown
+COc1cc2c(c(OC)c1OC)CCN=C2	C12H15NO3	unknown
+COc1cc2c(cc1O)C(CC(C)C)N(C)CC2	C15H23NO2	unknown
+COc1ccc2c(c1OC)C(C)N(C)CC2	C13H19NO2	unknown
+COc1cc2c(c(OC)c1OC)CN(C)CC2	C13H19NO3	unknown
+COc1cc2c(c(OC)c1OC)CCNC2	C12H17NO3	unknown
+COc1cc2cnccc2c(OC)c1OC	C12H13NO3	unknown
+COc1cc2c(c(OC)c1OC)CCN(C)C2	C13H19NO3	unknown
+COc1cc2c(c(OC)c1OC)CC[N+](C)([O-])C2	C13H19NO4	unknown
+COc1cc(SCCSC)c(OC)cc1C=O	C12H16O3S2	unknown
+COc1cc(SC2CCC2)c(OC)cc1C=O	C13H16O3S	unknown
+COc1cc(SC2CCCC2)c(OC)cc1C=O	C14H18O3S	unknown
+COc1cc(SCC2CC2)c(OC)cc1C=O	C13H16O3S	unknown
+COc1cc(SC2CC2)c(OC)cc1C=O	C12H14O3S	unknown
+COc1cc([Se]C)c(OC)cc1C=O	C10H12O3Se	unknown
+COc1cc(Sc2ccccc2)c(OC)cc1C=O	C15H14O3S	unknown
+CCCCCc1cc(OC)c(C=O)cc1OC	C14H20O3	unknown
+CCCCc1cc(OC)c(C=O)cc1OC	C13H18O3	unknown
+CCCOc1cc(OC)c(C=O)cc1OC	C12H16O4	unknown
+CCCc1cc(OC)c(C=O)cc1OC	C12H16O3	unknown
+COc1cc(OC(C)C)c(OC)cc1C=O	C12H16O4	unknown
+Cc1ccc(C)c(C=O)c1	C9H10O	unknown
+COc1cc(SC(C)C)cc(OC)c1C=O	C12H16O3S	unknown
+COc1cc(C)cc(OC)c1C=O	C10H12O3	unknown
+CCCSc1cc(OCC)c(C=O)cc1OC	C13H18O3S	unknown
+COc1c(C)cc(SC)cc1C=O	C10H12O2S	unknown
+COc1cc(C)c(SC)cc1C=O	C10H12O2S	unknown
+Cc1cc2c(cc1C=O)OCO2	C9H8O3	unknown
+O=Cc1cc2c(cc1[N+](=O)[O-])OCO2	C8H5NO5	unknown
+CCOc1cc(C=O)cc(SCC)c1OCC	C13H18O3S	unknown
+CCOc1cc(C=O)cc(SC)c1OCC	C12H16O3S	unknown
+CCOc1cc(C=O)cc(O)c1OCC	C11H14O4	unknown
+COc1ccc(C=O)c(SC)c1OC	C10H12O3S	unknown
+COc1cc(C=O)cc(SC)c1OC	C10H12O3S	unknown
+CCCOc1cc(C=O)cc(OC)c1OC	C12H16O4	unknown
+O=Cc1ccc2c(c1)OCCO2	C9H8O3	unknown
+CSc1c(C=O)ccc2c1OCO2	C9H8O3S	unknown
+CCOc1cc(C=O)cc(Br)c1OCC	C11H13BrO3	unknown
+O=Cc1cc(O)c(O)c(Br)c1	C7H5BrO3	unknown
+O=Cc1cc(Br)c2c(c1)OCO2	C8H5BrO3	unknown
+CCOc1c(Br)cc(C=O)cc1OC	C10H11BrO3	unknown
+CCOc1cc(C=O)cc(Br)c1OC	C10H11BrO3	unknown
+CCOc1cc(C=O)cc(SC)c1OC	C11H14O3S	unknown
+CCOc1cc(C=O)cc(SCC)c1OC	C12H16O3S	unknown
+CCOc1cc(C=O)cc(O)c1OC	C10H12O4	unknown
+CCSc1cc(C=O)cc(OC)c1OC	C11H14O3S	unknown
+COc1cc(C=O)cc2c1OCCO2	C10H10O4	unknown
+COc1cc(C=O)c(OC)c2c1OC(C)O2	C11H12O5	unknown
+COc1ccc(C=O)c2c1CCC2	C11H12O2	unknown
+CCOc1cc(C=O)c(OC)cc1OCC	C12H16O4	unknown
+CCOc1c(OC)cc(C=O)cc1SCC	C12H16O3S	unknown
+CCOc1c(OC)cc(C=O)cc1SC	C11H14O3S	unknown
+CCc1cc(OC)c(C=O)cc1SC	C11H14O2S	unknown
+CCc1cc(SC)c(C=O)cc1OC	C11H14O2S	unknown
+COc1ccc(C=O)c2c1OCO2	C9H8O4	unknown
+CCOc1cc(C=O)c(OC)cc1C	C11H14O3	unknown
+CC[C@@H](C)Sc1cc(OC)c(C=O)cc1OC	C13H18O3S	unknown
+COc1cc(C)c(OC)c(OC)c1C=O	C11H14O4	unknown
+COc1c(C=O)ccc(SC)c1OC	C10H12O3S	unknown
+COc1ccc(C=O)c(C)c1C	C10H12O2	unknown
+CCOc1cc(OCC)c(OCC)cc1C=O	C13H18O4	unknown
+CCOc1cc(OCC)c(OC)cc1C=O	C12H16O4	unknown
+COc1ccc(C=O)c(OC)c1SC	C10H12O3S	unknown
+CCOc1cc(C=O)c(OC)cc1OC	C11H14O4	unknown
+COc1cc(C)c(C=O)c(OC)c1	C10H12O3	unknown
+CSc1cc(C=O)c(SC)cc1C	C10H12OS2	unknown
+COc1cc(SC(C)(C)C)c(OC)cc1C=O	C13H18O3S	unknown
+COc1cc(SCCF)c(OC)cc1C=O	C11H13FO3S	unknown
+COc1cc(C=O)c(OC)c2c1CCC2	C12H14O3	unknown
+COc1cc(C=O)c(OC)c(C)c1C	C11H14O3	unknown
+COCCSc1cc(OC)c(C=O)cc1OC	C12H16O4S	unknown
+COc1cc2c(cc1OC)C(CO)NCC2	C12H17NO3	unknown
+COc1cc2c(c(O)c1OC)CCN(C)C2C	C13H19NO3	unknown
+COc1cc2c(c([O-])c1OC)C=[N+](C)CC2	C12H15NO3	unknown
+COc1cc2c(c([O-])c1OC)C(C)=[N+](C)CC2	C13H17NO3	unknown
+COc1cc2c(cc1O)C=[N+](C)CC2	C11H13NO2	unknown
+COc1cc(C)cc(OC)c1C1CC1N	C12H17NO2	unknown
+COc1cc(OC)c(C2CC2N)c(OC)c1	C12H17NO3	unknown
+COc1cc(F)cc(OC)c1C1CC1N	C11H14FNO2	unknown
+CC(C)(NC(=O)c1cn(CC2CC3CCC2C3)c2ccccc12)c1ccccc1	C26H30N2O	unknown
+COc1cc(/C=C/[N+](=O)[O-])c(OC)c2c1CCC2	C13H15NO4	unknown
+COc1cc(OC(C)C)c(OC)cc1/C=C/[N+](=O)[O-]	C13H17NO5	unknown
+COc1ccccc1CCN1CC[C@H]2[C@@H](C1)c1cccc3c1N2CCN3C	C23H29N3O	unknown
+COc1ccccc1CCCN1CC[C@H]2[C@@H](C1)c1cccc3c1N2CCN3C	C24H31N3O	unknown
+CN1CCN2c3c(cccc31)[C@@H]1CNCC[C@@H]12	C14H19N3	unknown
+CN1CCN2c3c(cccc31)[C@@H]1CN(CCCC(=O)c3ccc(F)cc3)CC[C@@H]12	C24H28FN3O	unknown
+CN1C[C@H](C(=O)NCC(F)(F)F)C=C2c3cccc4[nH]cc(c34)C[C@H]21	C18H18F3N3O	unknown
+CCN(CCF)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C20H24FN3O	unknown
+CN1C[C@H](C(=O)N2CC(F)C2)C=C2c3cccc4[nH]cc(c34)C[C@H]21	C19H20FN3O	unknown
+CN1C[C@H](C(=O)N2CC3(COC3)C2)C=C2c3cccc4[nH]cc(c34)C[C@H]21	C21H23N3O2	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(CCF)C1	C21H26FN3O	unknown
+CN(CC(F)(F)F)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C19H20F3N3O	unknown
+COCCN(CC(F)F)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C21H25F2N3O2	unknown
+CN1C[C@H](C(=O)N2C3CCC2CC3)C=C2c3cccc4[nH]cc(c34)C[C@H]21	C22H25N3O	unknown
+COCCN(C)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C20H25N3O2	unknown
+CN1C[C@H](C(=O)N2CCOC2)C=C2c3cccc4[nH]cc(c34)C[C@H]21	C19H21N3O2	unknown
+CN1C[C@H](C(=O)NCC(F)F)C=C2c3cccc4[nH]cc(c34)C[C@H]21	C18H19F2N3O	unknown
+CN1C[C@H](C(=O)N(C2CC2)C2CC2)C=C2c3cccc4[nH]cc(c34)C[C@H]21	C22H25N3O	unknown
+CN1C[C@H](C(=O)N2CC3CCC2CC3)C=C2c3cccc4[nH]cc(c34)C[C@H]21	C23H27N3O	unknown
+CC1CCN(C(=O)[C@@H]2C=C3c4cccc5[nH]cc(c45)C[C@H]3N(C)C2)C1	C21H25N3O	unknown
+COc1cc(SC(C)C)cc(OC)c1/C=C/[N+](=O)[O-]	C13H17NO4S	unknown
+CCCc1cc(OC)c(/C=C/[N+](=O)[O-])cc1OC	C13H17NO4	unknown
+COc1cc(SCCSC)c(OC)cc1/C=C/[N+](=O)[O-]	C13H17NO4S2	unknown
+CN(C)/C=C/c1c([N+](=O)[O-])ccc2c1OCO2	C11H12N2O4	unknown
+COCCSc1cc(OC)c(/C=C/[N+](=O)[O-])cc1OC	C13H17NO5S	unknown
+CCN1CCCCC1OC(=O)C(O)(c1ccccc1)C1CCCC1	C20H29NO3	unknown
+COc1cc(SCCF)c(OC)cc1/C=C/[N+](=O)[O-]	C12H14FNO4S	unknown
+CCCOc1cc(/C=C/[N+](=O)[O-])cc(OC)c1OC	C13H17NO5	unknown
+CCOC(OCC)P(=O)(O)CCCN	C8H20NO4P	unknown
+O=C(O)/C=C1\CCCc2ccccc2C1O	C13H14O3	unknown
+CC(C)(C)[C@H](NC(=O)c1nn(CCCCCF)c2ccccc12)C(=O)O	C19H26FN3O3	cannabinoid
+CC(C)[C@H](NC(=O)c1nn(CCCCCF)c2ccccc12)C(=O)O	C18H24FN3O3	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1cn(CC2CCCCC2)c2ccccc12)C(=O)O	C22H30N2O3	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1cn(Cc2ccc(F)cc2)c2ccccc12)C(=O)O	C22H23FN2O3	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1nn(Cc2ccc(F)cc2)c2ccccc12)C(=O)O	C21H22FN3O3	cannabinoid
+COc1cc2c3c(c1OC)-c1cc4c(cc1CC3N(C)CC2)OCO4	C20H21NO4	unknown
+COc1cc2c3c(c1OC)-c1ccccc1CC3N(C)CC2	C19H21NO2	unknown
+CN1CCc2cc3c(c4c2[C@H]1Cc1ccccc1-4)OCO3	C18H17NO2	unknown
+CN1CCN(C2=Nc3ccccc3Oc3ccc(Cl)cc32)CC1	C18H18ClN3O	unknown
+C1CNCCN1	C4H10N2	unknown
+CN	CH5N	unknown
+CCC(=O)c1ccc(C)cc1Br	C10H11BrO	unknown
+CCN(CC)CC	C6H15N	unknown
+COc1ccc2c3c1O[C@H]1C(=O)C=C[C@H]4[C@@H](C2)N(C)CC[C@]314	C18H19NO3	unknown
+COc1ccc2c(c1O)-c1cc(O)cc3c1[C@@H](C2)N(C)CC3	C18H19NO3	unknown
+CN1CCc2cc(-c3ccc(O)cc3)cc3c2[C@H]1Cc1ccc(O)c(O)c1-3	C23H21NO3	unknown
+Cc1ccc(-c2cc3c4c(c2)-c2c(ccc(O)c2O)C[C@H]4N(C)CC3)cc1	C24H23NO2	unknown
+CN1CCc2cc(-c3ccccc3)cc3c2[C@H]1Cc1ccc(O)c(O)c1-3	C23H21NO2	unknown
+CN1CCc2cc(-c3ccc(F)cc3)cc3c2[C@H]1Cc1ccc(O)c(O)c1-3	C23H20FNO2	unknown
+CNC(C)Cc1cccc([N+](=O)[O-])c1	C10H14N2O2	unknown
+CNCC(OC)c1ccc(O)c(O)c1	C10H15NO3	unknown
+COC1CN(C)C2=CC(=O)C(=O)C=C21	C10H11NO3	unknown
+O=C1C=C2CC(C(=O)O)NC2=CC1=O	C9H7NO4	unknown
+CN(C)Cc1c[nH]c2ccc([N+](=O)[O-])cc12	C11H13N3O2	unknown
+CN(C)Cc1c[nH]c2ccc(C#N)cc12	C12H13N3	unknown
+CCc1c(C)[nH]c2ccc(N)cc12	C11H14N2	unknown
+CCc1c(C)[nH]c2ccc([N+](=O)[O-])cc12	C11H12N2O2	unknown
+Cc1[nH]c2ccc(CN)cc2c1C	C11H14N2	unknown
+CCCCCc1cc(OC(=O)CCCN(CC)CC)c2c(c1)OC(C)(C)[C@@H]1CCC(C)=C[C@@H]21	C29H45NO3	cannabinoid
+C=C(C)[C@@H]1CCC(C)=CC1c1c(O)cc(CCCCC)c(C(=O)O)c1OC	C23H32O4	cannabinoid
+CCCCCC(C)C(C)c1cc(O)c2c(c1)OC(C)(C)CC2c1ccncc1	C25H35NO2	cannabinoid
+CCCCCc1cc(O)c2c(c1)OC(C)(C)CC2c1ccncc1	C21H27NO2	cannabinoid
+CCCCCc1cc(O)c2c(c1)OC(C)(C)C1=C2CCC2(C)CCCCC12	C25H36O2	cannabinoid
+CCCCCC(C)C(C)c1cc(O)c2c(c1)OC(C)(C)C1=C2CCS1	C22H32O2S	cannabinoid
+CCCCC(C)c1cc(O)c2c(c1)OC(C)(C)[C@@H]1CCC(C)=C[C@@H]21	C22H32O2	cannabinoid
+CCCCCC(C)C(C)c1cc(O)c2c(c1)OC(C)(C)[C@@H]1CCC(C)=C[C@@H]21	C25H38O2	cannabinoid
+CCCCCCc1cc(O)c2c(c1)OC(C)(C)[C@@H]1CC=C(C)C[C@@H]21	C22H32O2	cannabinoid
+CCCCC(C)c1cc(O)c2c(c1)OC(C)(C)[C@@H]1CC=C(C)C[C@@H]21	C22H32O2	unknown
+CCCC(C)C(C)c1cc(O)c2c(c1)OC(C)(C)[C@@H]1CC=C(C)C[C@@H]21	C23H34O2	unknown
+CCCCCc1cc(O)c2c(c1)OC(C)(C)[C@@H]1CC=C(CO)C[C@@H]21	C21H30O3	cannabinoid
+CCCCCc1cc(O)c2c(c1)OC(C)(C)[C@@H]1C(O)C=C(C)C[C@@H]21	C21H30O3	cannabinoid
+CCCCC(O)c1cc(O)c2c(c1)OC(C)(C)[C@@H]1CC=C(C)C[C@@H]21	C21H30O3	cannabinoid
+CCC(O)CCc1cc(O)c2c(c1)OC(C)(C)[C@@H]1CC=C(C)C[C@@H]21	C21H30O3	cannabinoid
+CCC(O)CCc1cc(O)c2c(c1)OC(C)(C)[C@@H]1CCC(CO)=C[C@@H]21	C21H30O4	cannabinoid
+CCCCCc1cc(O)c2c(c1)OC(C)(C)c1ccc(CO)cc1-2	C21H26O3	cannabinoid
+O=C1CCCN1CC#CCN1CCCC1	C12H18N2O	unknown
+CC(C)OP(=O)(F)OC(C)C	C6H14FO3P	unknown
+NCc1cc(O)n[nH]1	C4H7N3O	unknown
+NCc1cc(O)on1	C4H6N2O2	unknown
+NOCC(=O)O	C2H5NO3	unknown
+COC1=CC(=O)OC(CCc2ccc(OC)cc2)C1	C15H18O4	unknown
+CN(C)CCOC(=O)C(O)(c1ccccc1)C1CCCCC1	C18H27NO3	unknown
+COc1ccc2[nH]c3c(c2c1)CCNC3c1c(CO)cnc(C)c1O	C19H21N3O3	unknown
+CCC(=O)N(c1ccccc1)C1(C(=O)OC)CCN(CCc2ccccc2O)CC1	C24H30N2O4	fentanyl
+CCC(=O)N(c1ccccc1)C1(C(=O)OC)CCN(CCc2ccc(O)cc2)CC1	C24H30N2O4	fentanyl
+CCC(=O)N(c1ccccc1)C1(C(=O)OC)CC[N+]([O-])(CCc2ccccc2)CC1	C24H30N2O4	fentanyl
+CCC(=O)N(c1ccccc1)C1(C(=O)OC)CCN(CC(=O)c2ccccc2)CC1	C24H28N2O4	fentanyl
+COC(=O)C1(N(C(=O)CCO)c2ccccc2)CCN(CCc2ccccc2)CC1	C24H30N2O4	fentanyl
+CP(=O)(O)CCCN	C4H12NO2P	unknown
+CCC(=O)N(c1ccccc1)C1(C(=O)OC)CCN(CCc2ccccc2)C(O)C1	C24H30N2O4	fentanyl
+CC/C(=C\c1cc(OC)c(C)cc1OC)[N+](=O)[O-]	C13H17NO4	unknown
+CC/C(=C\c1ccc(OC)cc1OC)[N+](=O)[O-]	C12H15NO4	unknown
+CC/C(=C\c1cc(OC)cc(OC)c1)[N+](=O)[O-]	C12H15NO4	unknown
+CC/C(=C\c1c(OC)cccc1OC)[N+](=O)[O-]	C12H15NO4	unknown
+CC/C(=C\c1cc(SC)c(C)cc1OC)[N+](=O)[O-]	C13H17NO3S	unknown
+CC/C(=C\c1c(OC)cc(OC)cc1OC)[N+](=O)[O-]	C13H17NO5	unknown
+COc1cc(C)c(OC)c(C)c1C=O	C11H14O3	unknown
+COc1cc(C)c(OC)c(C)c1/C=C(\C)[N+](=O)[O-]	C13H17NO4	unknown
+COc1cc(CC(C)NC=O)c(OC)cc1C	C13H19NO3	unknown
+CSc1cc(/C=C(\C)[N+](=O)[O-])c(SC)cc1C	C12H15NO2S2	unknown
+CSc1cc(/C=C/[N+](=O)[O-])c(SC)cc1C	C11H13NO2S2	unknown
+CCOc1ccc(OC)cc1/C=C/[N+](=O)[O-]	C11H13NO4	unknown
+CCOc1ccc(OCC)c(C=O)c1	C11H14O3	unknown
+CCOc1ccc(OCC)c(/C=C/[N+](=O)[O-])c1	C12H15NO4	unknown
+COc1cc(/C=C(\C)[N+](=O)[O-])cc(OC)c1OCc1ccccc1	C18H19NO5	unknown
+COc1cc(/C=C(\C)[N+](=O)[O-])cc(OC)c1OCc1ccc(F)cc1	C18H18FNO5	unknown
+CCOc1cc(C)c(OC)cc1C=O	C11H14O3	unknown
+CCOc1cc(C)c(OC)cc1/C=C/[N+](=O)[O-]	C12H15NO4	unknown
+CCOc1cc(/C=C/[N+](=O)[O-])c(OC)cc1C	C12H15NO4	unknown
+CCOc1cc(/C=C/[N+](=O)[O-])c(OCC)cc1C	C13H17NO4	unknown
+CCOc1c(OC)cc(/C=C(\C)[N+](=O)[O-])cc1OC	C13H17NO5	unknown
+COc1ccc(/C=C(\C)[N+](=O)[O-])c2c1CCC2	C13H15NO3	unknown
+COc1cc(C=O)c(OC)c2c1CCCC2	C13H16O3	unknown
+COc1cc(/C=C/[N+](=O)[O-])c(OC)c2c1CCCC2	C14H17NO4	unknown
+COc1cc(C=O)c(OC)c2c1C1CCC2C1	C14H16O3	unknown
+COc1cc(/C=C/[N+](=O)[O-])c(OC)c2c1C1CCC2C1	C15H17NO4	unknown
+COc1cc(C=O)c(OC)c2ccccc12	C13H12O3	unknown
+COc1cc(/C=C/[N+](=O)[O-])c(OC)c2ccccc12	C14H13NO4	unknown
+CCOc1cc(C=O)c(OC)cc1SC	C11H14O3S	unknown
+CCOc1cc(/C=C/[N+](=O)[O-])c(OC)cc1SC	C12H15NO4S	unknown
+CCOc1cc(SCC)c(OC)cc1/C=C/[N+](=O)[O-]	C13H17NO4S	unknown
+CCOc1cc(C=O)c(OC)cc1SCC	C12H16O3S	unknown
+CCOc1cc(/C=C/[N+](=O)[O-])c(OC)cc1SCC	C13H17NO4S	unknown
+CCOc1cc(SC(C)C)c(OC)cc1C=O	C13H18O3S	unknown
+CCOc1cc(SC(C)C)c(OC)cc1/C=C/[N+](=O)[O-]	C14H19NO4S	unknown
+CC/C(=C\c1c(OC)cc(SC(C)C)cc1OC)[N+](=O)[O-]	C15H21NO4S	unknown
+CCCSc1cc(OCC)c(/C=C/[N+](=O)[O-])cc1OC	C14H19NO4S	unknown
+COc1cc(SC(C)(C)C)c(OC)cc1/C=C/[N+](=O)[O-]	C14H19NO4S	unknown
+COc1cc(SCCF)c(OC)cc1/C=C(\C)[N+](=O)[O-]	C13H16FNO4S	unknown
+C/C(=C\c1cc(C)ccc1C)[N+](=O)[O-]	C11H13NO2	unknown
+CCCCCc1cc(OC)c(/C=C(\C)[N+](=O)[O-])cc1OC	C16H23NO4	unknown
+CCCCc1cc(OC)c(/C=C(\C)[N+](=O)[O-])cc1OC	C15H21NO4	unknown
+CCC(C)c1cc(OC)c(C=O)cc1OC	C13H18O3	unknown
+COc1cc(C(C)(C)C)c(OC)cc1/C=C(\C)[N+](=O)[O-]	C15H21NO4	unknown
+CCc1cc(OC)c(/C=C(\C)[N+](=O)[O-])cc1OC	C13H17NO4	unknown
+COc1cc(OC)c(C=O)cc1C	C10H12O3	unknown
+COc1cc(OC)c(/C=C(\C)[N+](=O)[O-])cc1C	C12H15NO4	unknown
+COc1cc(C)cc(OC)c1/C=C(\C)[N+](=O)[O-]	C12H15NO4	unknown
+COc1cc(C)c(OC)c(OC)c1/C=C(\C)[N+](=O)[O-]	C13H17NO5	unknown
+CCCc1cc(OC)c(/C=C(\C)[N+](=O)[O-])cc1OC	C14H19NO4	unknown
+CCOc1cc(OCC)c(OC)cc1/C=C(\C)[N+](=O)[O-]	C14H19NO5	unknown
+CCOc1cc(OC)c(OCC)cc1/C=C(\C)[N+](=O)[O-]	C14H19NO5	unknown
+CCOc1cc(OC)c(OC)cc1/C=C(\C)[N+](=O)[O-]	C13H17NO5	unknown
+COc1cc2c(cc1C=O)OC(C)C2	C11H12O3	unknown
+COc1cc2c(cc1/C=C(\C)[N+](=O)[O-])OC(C)C2	C13H15NO4	unknown
+COc1cc2c(cc1C=O)OCC2	C10H10O3	unknown
+COc1cc2c(cc1/C=C(\C)[N+](=O)[O-])OCC2	C12H13NO4	unknown
+COc1cc2c(cc1C=O)OC(C)(C)C2	C12H14O3	unknown
+COc1cc2c(cc1/C=C(\C)[N+](=O)[O-])OC(C)(C)C2	C14H17NO4	unknown
+COc1cc(/C=C(\C)[N+](=O)[O-])c(OC)c2c1CCC2	C14H17NO4	unknown
+COc1cc(/C=C(\C)[N+](=O)[O-])c(OC)c2c1CCCC2	C15H19NO4	unknown
+COc1cc(/C=C(\C)[N+](=O)[O-])c(OC)c2c1C1CCC2C1	C16H19NO4	unknown
+COc1cc(/C=C(\C)[N+](=O)[O-])c(OC)c(C)c1C	C13H17NO4	unknown
+COc1cc(/C=C(\C)[N+](=O)[O-])c(OC)c2ccccc12	C15H15NO4	unknown
+CCOc1cc(/C=C(\C)[N+](=O)[O-])c(OC)cc1C	C13H17NO4	unknown
+C/C(=C\c1cc2c(cc1C)OCO2)[N+](=O)[O-]	C11H11NO4	unknown
+Cc1c(C=O)ccc2c1OCO2	C9H8O3	unknown
+C/C(=C\c1ccc2c(c1C)OCO2)[N+](=O)[O-]	C11H11NO4	unknown
+C/C(=C\c1ccc2c(c1)OCCO2)[N+](=O)[O-]	C11H11NO4	unknown
+CCOc1cc(C=O)cc(Br)c1O	C9H9BrO3	unknown
+COc1cc(/C=C(\C)[N+](=O)[O-])cc2c1OCCO2	C12H13NO5	unknown
+COc1cc(C=O)cc2c1OCCCO2	C11H12O4	unknown
+COc1cc(/C=C(\C)[N+](=O)[O-])cc2c1OCCCO2	C13H15NO5	unknown
+COc1cc(C=O)cc2c1OC(C)O2	C10H10O4	unknown
+CCOc1cc(/C=C(\C)[N+](=O)[O-])c(OC)cc1OCC	C14H19NO5	unknown
+CCOc1cc(C=O)ccc1O	C9H10O3	unknown
+COc1cc2c(cc1/C=C/[N+](=O)[O-])OCO2	C10H9NO5	unknown
+CC/C(=C\c1cc2c(cc1OC)OCO2)[N+](=O)[O-]	C12H13NO5	unknown
+COc1c(/C=C/[N+](=O)[O-])ccc2c1OCO2	C10H9NO5	unknown
+CC/C(=C\c1ccc2c(c1OC)OCO2)[N+](=O)[O-]	C12H13NO5	unknown
+COc1ccc(/C=C(\C)[N+](=O)[O-])c2c1OCO2	C11H11NO5	unknown
+COc1ccc2c(c1C=O)OCO2	C9H8O4	unknown
+COc1ccc2c(c1/C=C(\C)[N+](=O)[O-])OCO2	C11H11NO5	unknown
+CCOc1cc(/C=C(\C)[N+](=O)[O-])c(OC)cc1OC	C13H17NO5	unknown
+COc1cc(C=O)cc(OC(C)C)c1OC	C12H16O4	unknown
+CCCOc1cc(OC)c(/C=C(\C)[N+](=O)[O-])cc1OC	C14H19NO5	unknown
+COc1cc(OC(C)C)c(OC)cc1/C=C(\C)[N+](=O)[O-]	C14H19NO5	unknown
+CCCCOc1cc(OC)c(C=O)cc1OC	C13H18O4	unknown
+CCCCOc1cc(OC)c(/C=C(\C)[N+](=O)[O-])cc1OC	C15H21NO5	unknown
+CCCCCOc1cc(OC)c(C=O)cc1OC	C14H20O4	unknown
+CCCCCOc1cc(OC)c(/C=C(\C)[N+](=O)[O-])cc1OC	C16H23NO5	unknown
+CN1CCN(Cc2ccc3c(c2)OCO3)CC1	C13H18N2O2	unknown
+COc1cc(CN2CCNCC2)c(OC)cc1C	C14H22N2O2	unknown
+COc1cc(/C=C(\C)[N+](=O)[O-])c(OC)c(OC)c1OC	C13H17NO6	unknown
+CSc1c(/C=C(\C)[N+](=O)[O-])ccc2c1OCO2	C11H11NO4S	unknown
+COc1cc2c(cc1C=O)OCS2	C9H8O3S	unknown
+COc1cc2c(cc1/C=C(\C)[N+](=O)[O-])OCS2	C11H11NO4S	unknown
+COc1cc(OC)c(OC)cc1/C=C/[N+](=O)[O-]	C11H13NO5	unknown
+CCc1cc(SC)c(/C=C(\C)[N+](=O)[O-])cc1OC	C13H17NO3S	unknown
+CCc1cc(SC)c(/C=C/[N+](=O)[O-])cc1OC	C12H15NO3S	unknown
+CCc1cc(OC)c(/C=C(\C)[N+](=O)[O-])cc1SC	C13H17NO3S	unknown
+CCc1cc(OC)c(/C=C/[N+](=O)[O-])cc1SC	C12H15NO3S	unknown
+COc1cc(/C=C(\C)[N+](=O)[O-])c(SC)cc1C	C12H15NO3S	unknown
+COc1cc(/C=C/[N+](=O)[O-])c(SC)cc1C	C11H13NO3S	unknown
+COc1cc(C)c(SC)cc1/C=C(\C)[N+](=O)[O-]	C12H15NO3S	unknown
+COc1cc(C)c(SC)cc1/C=C/[N+](=O)[O-]	C11H13NO3S	unknown
+CN(C)CCc1c[nH]c2cccc(N=Nc3ccccc3)c12	C18H20N4	tryptamine
+CN(C)CCc1c[nH]c2ccc(N=Nc3ccccc3)cc12	C18H20N4	tryptamine
+CN(C)CCc1c[nH]c2cc(N=Nc3ccccc3)ccc12	C18H20N4	tryptamine
+Cc1ccc(N=Nc2ccc3[nH]cc(CCN(C)C)c3c2)cc1	C19H22N4	tryptamine
+Cc1cccc(N=Nc2ccc3[nH]cc(CCN(C)C)c3c2)c1	C19H22N4	tryptamine
+Cc1ccccc1N=Nc1ccc2[nH]cc(CCN(C)C)c2c1	C19H22N4	tryptamine
+CC(C)c1ccc(N=Nc2ccc3[nH]cc(CCN(C)C)c3c2)cc1	C21H26N4	tryptamine
+CC(C)c1cccc(N=Nc2ccc3[nH]cc(CCN(C)C)c3c2)c1	C21H26N4	tryptamine
+CC(C)c1ccccc1N=Nc1ccc2[nH]cc(CCN(C)C)c2c1	C21H26N4	tryptamine
+COc1ccc(N=Nc2ccc3[nH]cc(CCN(C)C)c3c2)cc1	C19H22N4O	tryptamine
+COc1cccc(N=Nc2ccc3[nH]cc(CCN(C)C)c3c2)c1	C19H22N4O	tryptamine
+CC(C)Oc1cccc(N=Nc2ccc3[nH]cc(CCN(C)C)c3c2)c1	C21H26N4O	tryptamine
+C=CCN1C[C@H](C(=O)N(CC)CC)C=C2c3cccc4c3c(cn4C(=O)CC)C[C@H]21	C25H31N3O2	unknown
+CCCCCn1cc(C(=O)N2CCNCC2)c2ccccc21	C18H25N3O	cannabinoid
+CCCCCn1cc(C(=O)N2CCN(CC)CC2)c2ccccc21	C20H29N3O	cannabinoid
+CCCCCn1cc(C(=O)N2CCN(CCC)CC2)c2ccccc21	C21H31N3O	cannabinoid
+CCCCCn1cc(C(=O)N2CCN(Cc3ccccc3)CC2)c2ccccc21	C25H31N3O	cannabinoid
+CCCCCn1cc(C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c2ccccc21	C23H33N3O3	cannabinoid
+O=C(c1cn(CCCCCF)c2ccccc12)N1CCNCC1	C18H24FN3O	cannabinoid
+CN1CCN(C(=O)c2cn(CCCCCF)c3ccccc23)CC1	C19H26FN3O	cannabinoid
+CCN1CCN(C(=O)c2cn(CCCCCF)c3ccccc23)CC1	C20H28FN3O	cannabinoid
+CCCN1CCN(C(=O)c2cn(CCCCCF)c3ccccc23)CC1	C21H30FN3O	cannabinoid
+CC(C)(C)OC(=O)N1CCN(C(=O)c2cn(CCCCCF)c3ccccc23)CC1	C23H32FN3O3	cannabinoid
+CCCCCn1c2ccccc2c2cc(C(=O)N3CCN(CC(=O)NC(C)(C)C)CC3)ccc21	C28H38N4O2	cannabinoid
+CCCCCn1cc(C(=O)O)c2ccccc21	C14H17NO2	unknown
+O=C(O)c1cn(CCCCCF)c2ccccc12	C14H16FNO2	unknown
+CC(C)CCc1c[nH]c2cccc(O)c12	C13H17NO	unknown
+O=C1NCN(c2ccccc2)C12CCNCC2	C13H17N3O	unknown
+O=c1[nH]c2ccccc2n1C1CCNCC1	C12H15N3O	unknown
+CN1CCN2c3c(cccc31)[C@@H]1CN(CCC(=O)c3ccccc3)CC[C@@H]12	C23H27N3O	unknown
+CN1CCN2c3c(cccc31)[C@@H]1CN(CCC(=O)c3ccc(F)cc3)CC[C@@H]12	C23H26FN3O	unknown
+CN1CCN2c3c(cccc31)[C@@H]1CN(CCc3ccccc3O)CC[C@@H]12	C22H27N3O	unknown
+CN1CCN2c3c(cccc31)[C@@H]1CN(CCCc3ccccc3O)CC[C@@H]12	C23H29N3O	unknown
+COc1ccccc1CN1CC[C@H]2[C@@H](C1)c1cccc3c1N2CCN3C	C22H27N3O	unknown
+CN1CCN2c3c(cccc31)[C@@H]1CN(Cc3ccccc3O)CC[C@@H]12	C21H25N3O	unknown
+O=C(CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1)c1ccc(F)cc1	C23H26FN3O2	unknown
+CCCCCCCC/C=C\CCCCCCCC(=O)NCCO	C20H39NO2	unknown
+CCCCCCCC/C=C\CCCCCCCC(=O)OCC(O)CO	C21H40O4	unknown
+CCCCCCCC/C=C\CCCCCCCC(=O)O	C18H34O2	unknown
+CCCCCCCC/C=C\CCCCCCCC(=O)OC(CO)CO	C21H40O4	unknown
+CCCCCCCC/C=C\CCCCCCCC(=O)OCC(O)COP(=O)(O)O	C21H41O7P	unknown
+Brc1ccc2c(c1)OCO2	C7H5BrO2	unknown
+COc1cc(F)c(F)cc1C1CC1CN	C11H13F2NO	unknown
+NCC1CC1c1cc(F)c(F)cc1OCCF	C12H14F3NO	unknown
+C=CCOc1cc(F)c(F)cc1C1CC1CN	C13H15F2NO	unknown
+COc1ccc(F)c(F)c1C1CC1CN	C11H13F2NO	unknown
+NCC1CC1c1c(OCCF)ccc(F)c1F	C12H14F3NO	unknown
+C=CCOc1ccc(F)c(F)c1C1CC1CN	C13H15F2NO	unknown
+COc1cc(F)c(Cl)cc1C1CC1CN	C11H13ClFNO	unknown
+NCC1CC1c1cc(Cl)c(F)cc1OCCF	C12H14ClF2NO	unknown
+C=CCOc1cc(F)c(Cl)cc1C1CC1CN	C13H15ClFNO	unknown
+COc1ccc(Cl)c(F)c1C1CC1CN	C11H13ClFNO	unknown
+NCC1CC1c1c(OCCF)ccc(Cl)c1F	C12H14ClF2NO	unknown
+C=CCOc1ccc(Cl)c(F)c1C1CC1CN	C13H15ClFNO	unknown
+COc1cc(Cl)c(Cl)cc1C1CC1CN	C11H13Cl2NO	unknown
+NCC1CC1c1cc(Cl)c(Cl)cc1OCCF	C12H14Cl2FNO	unknown
+C=CCOc1cc(Cl)c(Cl)cc1C1CC1CN	C13H15Cl2NO	unknown
+COc1ccc(Cl)c(Cl)c1C1CC1CN	C11H13Cl2NO	unknown
+NCC1CC1c1c(OCCF)ccc(Cl)c1Cl	C12H14Cl2FNO	unknown
+C=CCOc1ccc(Cl)c(Cl)c1C1CC1CN	C13H15Cl2NO	unknown
+COc1ccc(F)c(Cl)c1C1CC1CN	C11H13ClFNO	unknown
+NCC1CC1c1c(OCCF)ccc(F)c1Cl	C12H14ClF2NO	unknown
+C=CCOc1ccc(F)c(Cl)c1C1CC1CN	C13H15ClFNO	unknown
+COc1ccc2c3c([nH]c2n1)CCN(C)CC3	C13H17N3O	unknown
+COc1ccc2c3c([nH]c2n1)CCNCC3	C12H15N3O	unknown
+COc1ccc2c3c(n(C)c2n1)CCN(C)CC3	C14H19N3O	unknown
+COc1ccc2c3c([nH]c2n1)CCN(C1COC1)CC3	C15H19N3O2	unknown
+COc1ccc2c3c(n(C)c2n1)CCNCC3	C13H17N3O	unknown
+COc1ccc2c3c(n(C)c2n1)CCN(C1COC1)CC3	C16H21N3O2	unknown
+Cc1ccc2c3c([nH]c2n1)CCN(C)CC3	C13H17N3	unknown
+Cc1ccc2c3c([nH]c2n1)CCNCC3	C12H15N3	unknown
+Cc1ccc2c3c([nH]c2n1)CCN(C1COC1)CC3	C15H19N3O	unknown
+Cc1ccc2c3c(n(C)c2n1)CCNCC3	C13H17N3	unknown
+Cc1ccc2c3c(n(C)c2n1)CCN(C1COC1)CC3	C16H21N3O	unknown
+Cc1ccc2c3c(n(C)c2n1)CCN(C)CC3	C14H19N3	unknown
+Clc1cnc2[nH]c3c(c2c1)CCNCC3	C11H12ClN3	unknown
+COc1cc2c3c([nH]c2cn1)CCN(C)CC3	C13H17N3O	unknown
+COc1ccc2[nH]c3c(c2n1)CCN(C)CC3	C13H17N3O	unknown
+Brc1ccc2c3c([nH]c2n1)CCNCC3	C11H12BrN3	unknown
+c1cnc2[nH]c3c(c2c1)CCNCC3	C11H13N3	unknown
+Cn1c2c(c3cccnc31)CCNCC2	C12H15N3	unknown
+CN1CCc2[nH]c3nc(Br)ccc3c2CC1	C12H14BrN3	unknown
+CN1CCc2[nH]c3ncccc3c2CC1	C12H15N3	unknown
+CN1CCc2c(n(C)c3ncccc23)CC1	C13H17N3	unknown
+c1cnc2[nH]c3c(c2c1)CCN(C1COC1)CC3	C14H17N3O	unknown
+Cn1c2c(c3cccnc31)CCN(C1COC1)CC2	C15H19N3O	unknown
+Brc1ccc2c3c([nH]c2n1)CCN(C1COC1)CC3	C14H16BrN3O	unknown
+Cn1c2c(c3ccc(Br)nc31)CCNCC2	C12H14BrN3	unknown
+CN1CCc2[nH]c3ncc(Cl)cc3c2CC1	C12H14ClN3	unknown
+Clc1cnc2[nH]c3c(c2c1)CCN(C1COC1)CC3	C14H16ClN3O	unknown
+Cn1c2c(c3cc(Cl)cnc31)CCNCC2	C12H14ClN3	unknown
+Cn1c2c(c3cc(Cl)cnc31)CCN(C1COC1)CC2	C15H18ClN3O	unknown
+CN1CCc2c(n(C)c3ncc(Cl)cc23)CC1	C13H16ClN3	unknown
+COCCNC1(c2ccccc2)CCCCC1=O	C15H21NO2	arylcycloalkylamine
+O=C1CCCCC1(NCCO)c1ccccc1	C14H19NO2	arylcycloalkylamine
+[2H]C([2H])([2H])NC1(c2ccccc2)CCCCC1=O	C13H17NO	arylcycloalkylamine
+O=C1CCCCC1(NCCF)c1ccccc1	C14H18FNO	arylcycloalkylamine
+CC(C)NC1(c2ccccc2)CCCCC1=O	C15H21NO	arylcycloalkylamine
+O=C1CCCCC1(c1ccccc1)N1CCC1	C15H19NO	arylcycloalkylamine
+Cc1ccccc1C1(N)CCCCC1=O	C13H17NO	arylcycloalkylamine
+O=C1CCCCC1(c1ccccc1)N1CCOCC1	C16H21NO2	arylcycloalkylamine
+NC1(c2ccc(F)cc2)CCCCC1=O	C12H14FNO	arylcycloalkylamine
+Cc1cccc(C2(N)CCCCC2=O)c1	C13H17NO	arylcycloalkylamine
+Cc1ccc(C2(N)CCCCC2=O)cc1	C13H17NO	arylcycloalkylamine
+CNC1(c2ccc(C)cc2)CCCCC1=O	C14H19NO	arylcycloalkylamine
+CCN(CC)C1(c2ccccc2)CCCCC1=O	C16H23NO	arylcycloalkylamine
+CC1CCN1C1(c2ccccc2)CCCCC1=O	C16H21NO	arylcycloalkylamine
+CC1CN(C2(c3ccccc3)CCCCC2=O)C1	C16H21NO	arylcycloalkylamine
+COc1cc(C(F)(F)F)c(OC)cc1C1CCCNC1	C14H18F3NO2	unknown
+COc1cc(C2CCCNC2)c(OC)cc1Cl	C13H18ClNO2	unknown
+COc1cc(C2CCCNC2)c(OC)cc1I	C13H18INO2	unknown
+COc1cc(C2CCCNC2)c(OC)cc1C#N	C14H18N2O2	unknown
+COc1cc(C2CCCNC2)c(OC)cc1SC	C14H21NO2S	unknown
+CCOc1cc(C2CCCNC2)c(OC)cc1C(F)(F)F	C15H20F3NO2	unknown
+CCOc1cc(C(F)(F)F)c(OCC)cc1C1CCCNC1	C16H22F3NO2	unknown
+COc1cc(C2CCCNC2)c(OC)cc1C	C14H21NO2	unknown
+COc1cc(C2CCCNC2)c(OC)cc1SC(C)C	C16H25NO2S	unknown
+CCSc1cc(OC)c(C2CCCNC2)cc1OC	C15H23NO2S	unknown
+CCOc1cc(C(F)(F)F)c(OC)cc1C1CCCNC1	C15H20F3NO2	unknown
+CCc1cc(OC)c(C2CCCNC2)cc1OC	C15H23NO2	unknown
+CCOc1cc(C2CCCNC2)c(OC)cc1CC	C16H25NO2	unknown
+COc1cc(C(F)(F)F)c(OC)cc1C1CCCNC1C	C15H20F3NO2	unknown
+COc1cc(C(F)(F)F)c(OC)cc1C1CNCC(C)C1	C15H20F3NO2	unknown
+COc1cc(C(F)(F)F)c(OC)cc1C1CCC(C)NC1	C15H20F3NO2	unknown
+COc1cc(C2CCCNC2)c(OCF)cc1C(F)(F)F	C14H17F4NO2	unknown
+CCOc1cc(C2CCCNC2)c(OCC)cc1CC	C17H27NO2	unknown
+CCOc1cc(CC)c(OC)cc1C1CCCNC1	C16H25NO2	unknown
+COc1cc(C2CCCNC2)c(SC)cc1C(F)(F)F	C14H18F3NOS	unknown
+CCOc1cc(C2CCCNC2)c(SC)cc1C(F)(F)F	C15H20F3NOS	unknown
+COc1cc(C2CCCNC2)ccc1C(F)(F)F	C13H16F3NO	unknown
+COc1cc(C(F)(F)F)c(F)cc1C1CCCNC1	C13H15F4NO	unknown
+COc1cc(C(F)(F)F)ccc1C1CCCNC1	C13H16F3NO	unknown
+COc1cc(C2CCCNC2)c(OC2CC2)cc1C(F)(F)F	C16H20F3NO2	unknown
+CCCCc1cc(OC)c(C2CCCNC2)cc1OC	C17H27NO2	unknown
+CCN1CCCC(c2cc(OC)c(C(F)(F)F)cc2OC)C1	C16H22F3NO2	unknown
+COc1cc(C(F)(F)F)c(OC)cc1C1CCCN(C)C1	C15H20F3NO2	unknown
+COc1cc(C2CNC2)c(OC)cc1Br	C11H14BrNO2	unknown
+COc1cc(C(F)(F)F)c(OC)cc1C1CNC1	C12H14F3NO2	unknown
+COc1cc(C2CCNC2)c(OC)cc1Br	C12H16BrNO2	unknown
+COc1cc(C(F)(F)F)c(OC)cc1C1CCNC1	C13H16F3NO2	unknown
+CCN(CC)C(=O)C1C=C(c2c(OC)cccc2OC)CN(C)C1	C19H28N2O3	unknown
+CCN(CC)C(=O)C1C=C(c2cc(OC)cc(OC)c2)CN(C)C1	C19H28N2O3	unknown
+CCN(CC)C(=O)C1C=C(c2ccccc2OC)CN(C)C1	C18H26N2O2	unknown
+CCN(CC)C(=O)C1C=C(c2cccc(OC)c2)CN(C)C1	C18H26N2O2	unknown
+CCN(CC)C(=O)C1C=C(c2cccc3[nH]ccc23)CN(C)C1	C19H25N3O	unknown
+NC1Cc2cccc3ccn(c23)C1	C11H12N2	unknown
+CN(C)C1Cc2cccc3ccn(c23)C1	C13H16N2	unknown
+CCN(CC)C1Cc2cccc3ccn(c23)C1	C15H20N2	unknown
+NC1Cc2cc(F)cc3ccn(c23)C1	C11H11FN2	unknown
+CN(C)C1Cc2cc(F)cc3ccn(c23)C1	C13H15FN2	unknown
+NC1Cc2c(F)ccc3ccn(c23)C1	C11H11FN2	unknown
+CN(C)C1Cc2c(F)ccc3ccn(c23)C1	C13H15FN2	unknown
+NC1Cc2cc(Cl)cc3ccn(c23)C1	C11H11ClN2	unknown
+CN(C)C1Cc2cc(Cl)cc3ccn(c23)C1	C13H15ClN2	unknown
+NC1Cc2c(Cl)ccc3ccn(c23)C1	C11H11ClN2	unknown
+CN(C)C1Cc2c(Cl)ccc3ccn(c23)C1	C13H15ClN2	unknown
+COc1cc2c3c(ccn3CC(N)C2)c1	C12H14N2O	unknown
+COc1cc2c3c(ccn3CC(N(C)C)C2)c1	C14H18N2O	unknown
+CCN(CC)C1Cc2cccc3[nH]cc(c23)C1	C15H20N2	unknown
+NCCc1c[nH]c2cc(F)c(O)c(F)c12	C10H10F2N2O	tryptamine
+NC1CC1c1ccc(F)cc1	C9H10FN	unknown
+NCC(F)(F)c1ccccc1	C8H9F2N	unknown
+CC(NC1CC1)C(F)(F)c1ccc(Cl)cc1	C12H14ClF2N	unknown
+C=C(CNN)c1ccccc1	C9H12N2	unknown
+C=C(CNN)c1ccc(Cl)cc1	C9H11ClN2	unknown
+C=C(CNN)c1ccc(F)cc1	C9H11FN2	unknown
+COc1ccc2[nH]cc(CCNC3CC3)c2c1OC	C15H20N2O2	tryptamine
+COc1cc2[nH]cc(CCNC3CC3)c2cc1OC	C15H20N2O2	tryptamine
+NC1CC1(F)c1ccc(F)cc1	C9H9F2N	unknown
+NC1CC1(F)c1ccc(Cl)cc1	C9H9ClFN	unknown
+Cc1ccc(C2(F)CC2N)cc1	C10H12FN	unknown
+CCN(CC)C(=O)C(=O)c1c[nH]c2c(Br)cc(OC)cc12	C15H17BrN2O3	tryptamine
+COc1cc(Br)c2[nH]cc(/C=C/[N+](=O)[O-])c2c1	C11H9BrN2O3	unknown
+COc1cc(Br)c2[nH]cc(/C=C(\C)[N+](=O)[O-])c2c1	C12H11BrN2O3	unknown
+CC/C(=C\c1c[nH]c2c(Br)cc(OC)cc12)[N+](=O)[O-]	C13H13BrN2O3	unknown
+COc1cc(Br)c2c(c1)c(/C=C/[N+](=O)[O-])cn2C	C12H11BrN2O3	unknown
+COc1cc(I)c2[nH]cc(/C=C/[N+](=O)[O-])c2c1	C11H9IN2O3	unknown
+COc1cc(I)c2[nH]cc(/C=C(\C)[N+](=O)[O-])c2c1	C12H11IN2O3	unknown
+COc1ccc2c(c1)c(/C=C/[N+](=O)[O-])cn2C	C12H12N2O3	unknown
+COc1cc(C)c2[nH]cc(/C=C/[N+](=O)[O-])c2c1	C12H12N2O3	unknown
+COc1ccc(OC)c([N+](=O)[O-])c1/C=C/[N+](=O)[O-]	C10H10N2O6	unknown
+COc1cc(/C=C/[N+](=O)[O-])c([N+](=O)[O-])c(OC)c1	C10H10N2O6	unknown
+COc1cc2c3c(c1)c(/C=C/[N+](=O)[O-])cn3CCC2	C14H14N2O3	unknown
+COc1ccc2[nH]cc(CC(C)NC(=O)C(F)(F)F)c2c1	C14H15F3N2O2	tryptamine
+COc1cc(/C=C/[N+](=O)[O-])c([N+](=O)[O-])cc1OC	C10H10N2O6	unknown
+COc1ccc(OC)c2c(/C=C/[N+](=O)[O-])c[nH]c12	C12H12N2O4	unknown
+COc1ccc(OC)c2c(/C=C(\C)[N+](=O)[O-])c[nH]c12	C13H14N2O4	unknown
+COc1cc2[nH]cc(/C=C/[N+](=O)[O-])c2cc1OC	C12H12N2O4	unknown
+COc1cc(OC)c2[nH]cc(/C=C/[N+](=O)[O-])c2c1	C12H12N2O4	unknown
+COc1ccccc1CN(CCc1c[nH]c2c(OC)ccc(OC)c12)C(=O)OC(C)(C)C	C25H32N2O5	tryptamine
+COc1ccc(OC)c(C2CNCc3ccccc32)c1	C17H19NO2	unknown
+COc1ccc(OC)c(C2CNC(=O)c3ccccc3C2)c1	C18H19NO3	unknown
+COc1ccc(OC)c(C2CNCc3ccccc3C2)c1	C18H21NO2	unknown
+COc1ccc(OC)c(C2CCC(c3ccccc3OC)NC2)c1	C20H25NO3	unknown
+COc1ccc(OC)c(CC2CCCC(c3ccccc3OC)N2)c1	C21H27NO3	unknown
+COc1cc(C(F)(F)F)c(OC)cc1C=O	C10H9F3O3	unknown
+COc1cc(C(F)(F)F)c(OC)cc1/C=C/[N+](=O)[O-]	C11H10F3NO4	unknown
+O=Cc1cccc2ccoc12	C9H6O2	unknown
+O=Cc1cccc2ccsc12	C9H6OS	unknown
+O=Cc1cccc2cn[nH]c12	C8H6N2O	unknown
+O=Cc1cccc2c1OCC2	C9H8O2	unknown
+O=Cc1cccc2nc[nH]c12	C8H6N2O	unknown
+O=Cc1cccc2ncoc12	C8H5NO2	unknown
+COc1ncccc1C=O	C7H7NO2	unknown
+O=Cc1cc2ccccc2o1	C9H6O2	unknown
+COc1cc(C)c(C)cc1C=O	C10H12O2	unknown
+COc1ccc(Br)cc1C=O	C8H7BrO2	unknown
+COc1cc(C)ccc1C=O	C9H10O2	unknown
+CCc1ccc(C=O)c(OC)c1	C10H12O2	unknown
+CCCc1ccc(C=O)c(OC)c1	C11H14O2	unknown
+COc1cc(CC(C)C)ccc1C=O	C12H16O2	unknown
+COc1cc(COC(c2ccccc2)(c2ccccc2)c2ccccc2)ccc1C=O	C28H24O3	unknown
+COc1cc(CCOC(c2ccccc2)(c2ccccc2)c2ccccc2)ccc1C=O	C29H26O3	unknown
+COc1cc(CCN(Cc2ccccc2O)C(=O)OC(C)(C)C)c(OC)cc1I	C22H28INO5	unknown
+COc1cc(CCN(Cc2ccccc2OC)C(=O)OC(C)(C)C)c(O)cc1I	C22H28INO5	unknown
+COc1cc(CCN(Cc2ccccc2O[Si](C)(C)C(C)(C)C)C(=O)OC(C)(C)C)c(O)cc1I	C27H40INO5Si	unknown
+COc1cc(CCN(Cc2ccccc2F)C(=O)OC(C)(C)C)c(O)cc1I	C21H25FINO4	unknown
+COc1cc(CCN(Cc2cccc3c2OCO3)C(=O)OC(C)(C)C)c(O)cc1I	C22H26INO6	unknown
+CC(C)(C)OC(=O)N(CCc1c2c(c(Br)c3c1OCC3)OCC2)Cc1ccccc1O	C24H28BrNO5	unknown
+COc1cc(CCN(Cc2ccccc2O)C(=O)OC(C)(C)C)c(OC)cc1Br	C22H28BrNO5	unknown
+COc1cc(CCN(Cc2ccccc2O)C(=O)OC(C)(C)C)c(OC)cc1Cl	C22H28ClNO5	unknown
+COc1cc(C(F)(F)F)c(OC)cc1CCN(Cc1ccccc1O)C(=O)OC(C)(C)C	C23H28F3NO5	unknown
+COc1cc(CCN2C(=O)c3ccccc3C2=O)c(O)cc1I	C17H14INO4	unknown
+CCCCCn1cc(CC(=O)NC2CCCCC2)c2ccccc21	C21H30N2O	cannabinoid
+CC(c1ccc(Cl)cc1)N1CCC(n2c(=O)[nH]c3ccccc32)CC1	C20H22ClN3O	unknown
+CC(c1ccc(F)cc1)N1CCC(n2c(=O)[nH]c3ccccc32)CC1	C20H22FN3O	unknown
+CCCN(C)C(C)C(=O)c1ccc2c(c1)OCO2	C14H19NO3	beta-ketone
+CCCCn1nc(CC(=O)N[C@H](C(N)=O)C(C)(C)C)c2ccccc21	C19H28N4O2	cannabinoid
+C=CCCCn1nc(C(=O)N[C@H](C(=O)OCC)C(C)(C)C)c2ccccc21	C21H29N3O3	cannabinoid
+C=CCCCn1nc(-c2ccc(F)cc2)cc1C(=O)N[C@H](C(N)=O)C(C)(C)C	C21H27FN4O2	cannabinoid
+CC(C(=O)c1ccc2c(c1)OCO2)N(C)C1CCCCC1	C17H23NO3	beta-ketone
+CCN(CC)CCn1c(Cc2ccc(OCC(C)C)cc2)nc2cc([N+](=O)[O-])ccc21	C24H32N4O3	unknown
+CCC(C)Oc1ccc(Cc2nc3cc([N+](=O)[O-])ccc3n2CCN(CC)CC)cc1	C24H32N4O3	unknown
+CCCCNC(CC)C(=O)c1ccc2c(c1)OCO2	C15H21NO3	beta-ketone
+CNC(CC(C)C)C(=O)c1ccc(F)cc1	C13H18FNO	beta-ketone
+CCNC(CC(C)C)C(=O)c1ccc(F)cc1	C14H20FNO	beta-ketone
+CCCCCn1nc(C(=O)N[C@@H](CCC)C(N)=O)c2ccccc21	C18H26N4O2	cannabinoid
+O=C(N1CCCC1)C(CCN1CCOCC1)(c1ccccc1)c1ccccc1	C24H30N2O2	unknown
+CCC[C@H](NC(=O)c1nn(CC2CCCCC2)c2ccccc12)C(N)=O	C20H28N4O2	cannabinoid
+COC(=O)[C@@H](NC(=O)c1cn(Cc2ccccc2)c2ccccc12)C(C)(C)C	C23H26N2O3	cannabinoid
+C=CCCCN1C(=O)/C(=N\NC(=O)c2ccccc2)c2ccccc21	C20H19N3O2	cannabinoid
+CCC(=O)N(Cc1ccccc1)C1CCN(Cc2ccccc2)CC1	C22H28N2O	unknown
+Cn1c(=O)c2c(ncn2CC(=O)O)n(C)c1=O	C9H10N4O4	unknown
+Cc1cccc(-n2c(C)nc3ccccc3c2=O)c1C	C17H16N2O	unknown
+CC(C)(C)[C@H](NC(=O)c1n[nH]c2ccc(Br)cc12)C(N)=O	C14H17BrN4O2	cannabinoid
+CCNC(=O)[C@@H](NC(=O)c1nn(Cc2ccc(F)cc2)c2ccccc12)C(C)(C)C	C23H27FN4O2	cannabinoid
+CCCCCn1c2ccccc2c2c(=O)n(C(CC)c3ccccc3)ccc21	C25H28N2O	cannabinoid
+CCCCCn1nc(C(=O)N[C@H](C(=O)OCC)C(C)(C)C)c2ccccc21	C21H31N3O3	cannabinoid
+COc1cc(CCNCc2ccccc2O[Si](C)(C)C(C)(C)C)c(OC)cc1I	C23H34INO3Si	unknown
+COc1cc(CCN(Cc2ccccc2O[Si](C)(C)C(C)(C)C)C(=O)OC(C)(C)C)c(OC)cc1I	C28H42INO5Si	unknown
+COc1cc(C=O)c(O)cc1I	C8H7IO3	unknown
+COc1cc(/C=C/[N+](=O)[O-])c(O)cc1I	C9H8INO4	unknown
+COc1cc(CCNCc2ccccc2O[Si](C)(C)C(C)(C)C)c(O)cc1I	C22H32INO3Si	unknown
+COc1ccc(OC(C)C)c(CCN2C(=O)c3ccccc3C2=O)c1	C20H21NO4	unknown
+COc1cc(CCN2C(=O)c3ccccc3C2=O)c(OC(C)C)cc1I	C20H20INO4	unknown
+CCCN1C2CCC1[C@@H](C(=O)OC)[C@@H](c1ccc(I)cc1)C2	C18H24INO2	unknown
+CCCCN1C2CCC1[C@@H](C(=O)OC)[C@@H](c1ccc(I)cc1)C2	C19H26INO2	unknown
+COc1cc(CCNC(=O)C(F)(F)F)c(OC)cc1Br	C12H13BrF3NO3	unknown
+COc1cc(C(F)(F)F)c(OC)cc1CCNC(=O)C(F)(F)F	C13H13F6NO3	unknown
+COc1ccc(OC)c(CCNC(=O)OCc2ccccc2)c1	C18H21NO4	unknown
+COc1cc(CCNC(=O)OCc2ccccc2)c(OC)cc1Br	C18H20BrNO4	unknown
+CC/C(=C\c1c2c(cc3c1OCC3)OCC2)[N+](=O)[O-]	C14H15NO4	unknown
+O=C(NCCc1c2c(cc3c1OCC3)OCC2)C(F)(F)F	C14H14F3NO3	unknown
+CCC(Cc1c2c(cc3c1OCC3)OCC2)NC(=O)C(F)(F)F	C16H18F3NO3	unknown
+O=C(NCCc1c2c(c(Br)c3c1OCC3)OCC2)C(F)(F)F	C14H13BrF3NO3	unknown
+CCC(Cc1c2c(c(Br)c3c1OCC3)OCC2)NC(=O)C(F)(F)F	C16H17BrF3NO3	unknown
+O=C(NCCc1c2ccoc2c(Br)c2ccoc12)C(F)(F)F	C14H9BrF3NO3	unknown
+COc1cc(OCCN)c(Cl)cc1Cl	C9H11Cl2NO2	unknown
+COc1c(Cl)cc(Cl)c2c1CC(N)CO2	C10H11Cl2NO2	unknown
+COc1c(Cl)cc(Cl)c(OC)c1OCCN	C10H13Cl2NO3	unknown
+C=C(C)[C@@H]1CCC(C)=C[C@H]1c1c(OC)cc(CCCCC)c(C(=O)O)c1O	C23H32O4	cannabinoid
+CCCCCc1cc(OC)c(C/C=C(\C)CCC=C(C)C)c(O)c1C(=O)O	C23H34O4	cannabinoid
+CC(C)OC(=O)[C@@H](NC(=O)c1nn(Cc2ccc(F)cc2)c2ccccc12)C(C)(C)C	C24H28FN3O3	cannabinoid
+CCOC(=O)[C@@H](NC(=O)c1nn(CCCCF)c2ccccc12)C(C)(C)C	C20H28FN3O3	cannabinoid
+CCOC(=O)[C@@H](NC(=O)c1cn(CCCCF)c2ccccc12)C(C)C	C20H27FN2O3	cannabinoid
+O=C(NC12CC3CC(CC(C3)C1)C2)c1cn(Cc2ccc(F)cc2)c2ncccc12	C25H26FN3O	cannabinoid
+C=CC(=O)N(c1ccccc1F)C1CCN(CCc2ccccc2)CC1	C22H25FN2O	fentanyl
+COC(=O)[C@@H](NC(=O)c1n[nH]c2ccc(Br)cc12)C(C)(C)C	C15H18BrN3O3	cannabinoid
+COc1cc2c(CCNC(C)=O)c[nH]c2cc1O	C13H16N2O3	tryptamine
+C=CC(C)(C)c1[nH]c2cc(Br)ccc2c1CCNC	C16H21BrN2	tryptamine
+COc1c(Br)cc(Br)c2c(CCN(C)C)c(Br)n(OC)c12	C14H17Br3N2O2	tryptamine
+Fc1ccc2c(CCNCc3cccc(OCC(F)(F)C(F)F)c3)c[nH]c2c1	C20H19F5N2O	tryptamine
+c1ccc2c(CCN(C3CC3)C3CC3)c[nH]c2c1	C16H20N2	tryptamine
+CCCCN(CC)CCc1c[nH]c2ccccc12	C16H24N2	tryptamine
+CCCCN(CCC)CCc1c[nH]c2ccccc12	C17H26N2	tryptamine
+C=CCN(CCc1c[nH]c2ccccc12)C(C)C	C16H22N2	tryptamine
+Cc1cccc2[nH]cc(CCN(C)C)c12	C13H18N2	tryptamine
+CCN(C)CCc1c[nH]c2cccc(OP(=O)(O)O)c12	C13H19N2O4P	tryptamine
+CCCN(CC)CCc1c[nH]c2cccc(OP(=O)(O)O)c12	C15H23N2O4P	tryptamine
+CCCN(CCc1c[nH]c2cccc(OC(C)=O)c12)C(C)C	C18H26N2O2	tryptamine
+CC(C)N(CCc1c[nH]c2cccc(OC(=O)CCCC(=O)O)c12)C(C)C	C21H30N2O4	tryptamine
+CC(C)N(CCc1c[nH]c2cccc(OP(=O)(O)O)c12)C(C)C	C16H25N2O4P	tryptamine
+COc1ccc2[nH]cc(CCN(C)C3CC3)c2c1	C15H20N2O	tryptamine
+CCN(C)CCc1c[nH]c2ccc(OC(C)=O)cc12	C15H20N2O2	tryptamine
+CCN(CC)CCc1c[nH]c2ccc(OC(C)=O)cc12	C16H22N2O2	tryptamine
+CCCN(CC)CCc1c[nH]c2ccc(OC(C)=O)cc12	C17H24N2O2	tryptamine
+CC(=O)Oc1ccc2[nH]cc(CCN(C)C(C)C)c2c1	C16H22N2O2	tryptamine
+CC(=O)Oc1ccc2[nH]cc(CCN(C(C)C)C(C)C)c2c1	C18H26N2O2	tryptamine
+CCN(CC)CCc1c[nH]c2ccc(O)cc12	C14H20N2O	tryptamine
+CCN(C)CCc1c[nH]c2ccc(F)cc12	C13H17FN2	tryptamine
+CCCN(CC)CCc1c[nH]c2ccc(F)cc12	C15H21FN2	tryptamine
+CCCN(CCC)CCc1c[nH]c2ccc(F)cc12	C16H23FN2	tryptamine
+CCCN(CCC)CCc1c[nH]c2ccc(C#N)cc12	C17H23N3	tryptamine
+CN(C)CCc1c[nH]c2ccc(CS(=O)(=O)N3CCCC3)cc12	C17H25N3O2S	tryptamine
+CN(C)CCc1c[nH]c2c(Cl)cccc12	C12H15ClN2	tryptamine
+COc1ccc2c(c1)c(CCN(C(C)C)C(C)C)cn2C	C18H28N2O	tryptamine
+COc1ccc2[nH]cc(CCN(C)C)c2c1C	C14H20N2O	tryptamine
+Cc1[nH]c2ccc(Cl)cc2c1CCN(C)C	C13H17ClN2	tryptamine
+CC(N)Cc1c[nH]c2ccc(OC(C)C)cc12	C14H20N2O	tryptamine
+CC(N)Cc1c[nH]c2c(Cl)cccc12	C11H13ClN2	tryptamine
+C[C@H](N)Cn1ncc2ccc3c(c21)N(C)CCO3	C13H18N4O	unknown
+C[C@H](N)Cn1ncc2ccc3c(c21)OCCO3	C12H15N3O2	unknown
+CCC(C)(CC)OC(N)=O	C7H15NO2	unknown
+Cc1ccccc1C(=O)C(CC(C)C)N1CCCC1	C17H25NO	beta-ketone
+CC(NC1CCCCC1)C(=O)c1ccc2c(c1)OCO2	C16H21NO3	beta-ketone
+C[C@H](N)Cn1ncc2ccc3c(c21)C=CCO3	C13H15N3O	unknown
+C[C@H](N)Cn1ncc2ccc(O)c(Cl)c21	C10H12ClN3O	unknown
+C[C@H](N)CN1CCc2ccc(Br)cc21	C11H15BrN2	unknown
+Cc1cn(CC(C)N)c2c3c(ccc12)OCCC3	C15H20N2O	unknown
+O=C(Cc1cn(Cc2ccc(F)cc2)c2ccccc12)NC1CCCCC1	C23H25FN2O	cannabinoid
+CCC(NC1CCCCC1)C(=O)c1ccc2c(c1)OCO2	C17H23NO3	beta-ketone
+CCCCn1nc(C(=O)N[C@H](C(N)=O)C(C)(C)C)c2cc(Br)ccc21	C18H25BrN4O2	cannabinoid
+CN(C)[C@@H]1CCCC[C@H]1N(C)C(=O)c1ccc2ccccc2c1	C20H26N2O	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)C3(C)CCC3C)C[C@H]2N(C)C1	C27H35N3O2	unknown
+CN(C)CCc1c[nH]c2ccc([N+](=O)[O-])cc12	C12H15N3O2	tryptamine
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)CC[Si](C)(C)C)C[C@H]2N(C)C1	C26H37N3O2Si	unknown
+CC(=O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C	C21H34O2	unknown
+COC(=O)/C=C1\OC(C)(OC)OC12CCC1C3CCC4=CC(=O)CCC4C3CC[C@@]12C	C25H34O6	unknown
+CCC1=CC2C(C1)CC2(CN)CC(=O)O	C12H19NO2	unknown
+ClCCc1ccccc1	C8H9Cl	unknown
+CNC(CC(C)C)C(=O)c1ccc2c(c1)OCO2	C14H19NO3	beta-ketone
+COc1cc2c(cc1OC)[C@@H]1C[C@H](C[C@H]3CCCCN31)OC(=O)/C=C\c1ccc(O)c-2c1	C26H29NO5	unknown
+[2H]C([2H])([2H])N1CC[C@]23c4c5ccc(OC)c4O[C@H]2C(=O)CC[C@@]3(O)[C@H]1C5	C18H21NO4	unknown
+C=CCNCCc1c[nH]c2ccc(F)cc12	C13H15FN2	tryptamine
+[2H]c1c([2H])c([2H])c(N(C(=O)COC)C2CCN(CCc3ccccc3)CC2)c([2H])c1[2H]	C22H28N2O2	fentanyl
+CC(=O)O[C@H]1CC[C@@]2(C)C(=CC(=O)[C@@H]3[C@@H]2CC[C@]2(C)C(=O)CC[C@@H]32)C1	C21H28O4	unknown
+N#Cc1ccc(N2CCC[C@@H]2[C@@H](O)C(F)(F)F)cc1C(F)(F)F	C14H12F6N2O	unknown
+C[C@]12CCC=CC1=CC(=O)[C@@H]1[C@@H]2CC[C@]2(C)C(=O)CC[C@@H]12	C19H24O2	unknown
+CC(C)CC(C(=O)c1cccc(F)c1)N1CCCC1	C16H22FNO	beta-ketone
+CN1C(=O)C(F)=C[C@]2(C)[C@H]3CC[C@]4(C)[C@@H](C(=O)NCc5nc6ncccc6[nH]5)CC[C@H]4[C@@H]3CC[C@@H]12	C27H34FN5O2	unknown
+O=C(O)CC1NC(=O)C(Cc2ccccc2)NC1=O	C13H14N2O4	unknown
+CN1CCN(c2c(F)cc3c(=O)c(C(=O)O)cn(CCF)c3c2F)CC1	C17H18F3N3O3	unknown
+CN1C[C@@H]2C[C@H]1CN2c1cc2c(cc1F)c(=O)c(C(=O)O)cn2C1CC1	C19H20FN3O3	unknown
+Cc1ccc(N2CCNCC2)c(S(=O)(=O)O)c1	C11H16N2O3S	unknown
+O=C(O)CCn1c2c(c3ccccc31)C[C@H](NS(=O)(=O)c1ccc(F)cc1)CC2	C21H21FN2O4S	unknown
+O=C(OC1CCN(Cc2ccccc2)CC1)c1ccccc1I	C19H20INO2	unknown
+O=C(OC1CCN(Cc2ccccc2)CC1)c1ccc(I)cc1	C19H20INO2	unknown
+CC(C)N1CCC(OC(=O)c2ccc(I)cc2)CC1	C15H20INO2	unknown
+Cc1cn(-c2ccc(Cl)cc2Cl)nc1C(N)=O	C11H9Cl2N3O	unknown
+O=Cc1c[nH]c2ccccc12	C9H7NO	unknown
+CCN(CCCCOC(=O)c1ccc(OC)c(OC)c1)C(C)Cc1ccc(OC)cc1	C25H35NO5	unknown
+CC(C)(NC(=O)c1cn(CCCCCF)c2ccncc12)c1ccccc1	C22H26FN3O	cannabinoid
+CC(C)(NC(=O)c1cn(CCCCCF)c2cccnc12)c1ccccc1	C22H26FN3O	cannabinoid
+Nc1cc(N2CCCCC2)nc(N)[n+]1[O-]	C9H15N5O	unknown
+C/C(=C(\CCOC(=O)C(C)C)SS/C(CCOC(=O)C(C)C)=C(/C)N(C=O)Cc1cnc(C)nc1N)N(C=O)Cc1cnc(C)nc1N	C32H46N8O6S2	unknown
+C=CCN1CCC2(C)c3cc(O)ccc3CC1C2C	C17H23NO	unknown
+Oc1ccc2c(c1)[C@@]13CCCC[C@@]1(O)[C@@H](C2)N(CC1CC1)CC3	C20H27NO2	unknown
+C=C1C[C@H](C)C2[C@H]3Cc4ccc(O)cc4[C@@]2(CCN3CC2CCC2)C1	C23H31NO	unknown
+COc1ccc2c3c1O[C@H]1C(=O)C=C[C@@]4(OC(=O)/C=C/c5ccccc5)[C@@H](C2)N(C)CC[C@]314	C27H25NO5	unknown
+CCC(=O)N(c1ccccc1)C1CCN(CCc2cc(OC)c([N+](=O)[O-])cc2OC)CC1	C24H31N3O5	fentanyl
+COc1cc(C(C)N)c(OC)cc1Br	C10H14BrNO2	unknown
+CCN(CC)[C@@H]1CCCC[C@H]1N(C)C(=O)c1ccc(F)c(F)c1	C18H26F2N2O	unknown
+CCCCCCCCCCCC(=O)O	C12H24O2	unknown
+CCS(=O)(=O)C(CC(C)N(C)C)(c1ccccc1)c1ccccc1	C20H27NO2S	unknown
+COC(=O)c1ccccc1O	C8H8O3	unknown
+N#Cc1ccc(N2[C@@H]3CC[C@H]2C[C@@H](O)C3)c2ccccc12	C18H18N2O	unknown
+C[C@](O)(COc1ccc(Cl)c(F)c1)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1	C18H13ClF4N2O3	unknown
+O=c1cc(C(F)(F)F)c2cc(N(CC(F)(F)F)CC(F)(F)F)ccc2[nH]1	C14H9F9N2O	unknown
+CCc1c(C)c2c3c(Cl)cc(=O)[nH]c3ccc2n1CC(F)(F)F	C16H14ClF3N2O	unknown
+CN(C)C1CC(C(C)(C)CO)Nc2ccc([N+](=O)[O-])cc21	C15H23N3O3	unknown
+C[C@@]1(C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)CC(C(F)(F)F)=NN1	C14H10F6N4O	unknown
+CC1CCC(C(C)C)C(O)C1	C10H20O	unknown
+CCOC(=O)Cc1ccccc1	C10H12O2	unknown
+CCN(CC)CCOC(=O)C1(C2CCCCC2)CCCCC1	C19H35NO2	unknown
+CNC(=O)C(C)(O)C(NC)c1ccc2c(c1)OCO2	C13H18N2O4	unknown
+CN1C2CCC1CC(OC(=O)c1ccccc1F)C2	C15H18FNO2	unknown
+CCCCC(NCC)C(=O)c1cccc(F)c1	C14H20FNO	beta-ketone
+CCNC(CC)C(=O)c1ccccc1C	C13H19NO	beta-ketone
+CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1	C17H25NO3	unknown
+CC(C)(C)C(=O)CC(c1ccccc1)N1CCCC1	C17H25NO	unknown
+CC(C)CC(C(=O)c1ccc2c(c1)OCO2)N1CCCC1	C17H23NO3	beta-ketone
+Cc1ccc(-c2ncc(Cl)cc2-c2ccc(S(C)(=O)=O)cc2)cn1	C18H15ClN2O2S	unknown
+CN(C)C1(C(=O)c2ccc(Br)cc2)CCC(O)(CCc2ccccc2)CC1	C23H28BrNO2	unknown
+CCN(CC)C1C2CCC(C2)C1c1ccccc1	C17H25N	unknown
+CNC1CCCC1c1ccccc1	C12H17N	unknown
+CCC(COC(=O)c1cc(OC)c(OC)c(OC)c1)(c1ccccc1)N(C)C	C22H29NO5	unknown
+COC(=O)C(C(C)C)n1ccc2c(c1=O)c1ccccc1n2Cc1ccc(F)cc1	C24H23FN2O3	cannabinoid
+CN(C)CCc1c(-c2[nH]c3ccccc3c2CCN(C)C)[nH]c2ccccc12	C24H30N4	unknown
+CC(C)C(NC(=O)c1cn(CCCCC#N)c2ccccc12)C(N)=O	C19H24N4O2	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1nn(CC2CCCCC2)c2ccccc12)C(=O)OCC1CCCCC1	C28H41N3O3	cannabinoid
+CCCCC(C(=O)c1ccc(F)c(C)c1)N1CCCC1	C17H24FNO	beta-ketone
+CCCC(Cc1ccccc1)NCC	C13H21N	unknown
+Fc1ccc(N(CCc2ccccc2)C2CCN(CCc3ccccc3)CC2)cc1	C27H31FN2	fentanyl
+CCCNC(C)C(=O)c1cccc(C)c1	C13H19NO	beta-ketone
+CC[N+](=O)[O-]	C2H5NO2	unknown
+CN[C@]12CCCCC1Cc1ccccc12	C14H19N	unknown
+CC(C)NC1C2CCC(CC2)C1(O)c1ccc(Cl)c(Cl)c1	C17H23Cl2NO	unknown
+CNC(C(C)=O)c1cccc(Cl)c1	C10H12ClNO	unknown
+CNC(C)C(=O)c1ccc(Cl)c(C)c1	C11H14ClNO	beta-ketone
+Cc1ccc(S(=O)(=O)n2nc(C(=O)NC(C)(C)c3ccccc3)c3ccccc32)cc1	C24H23N3O3S	cannabinoid
+C=CCCCn1nc(C(=O)N[C@H](C(N)=O)C(C)(C)C)cc1-c1ccc(F)cc1	C21H27FN4O2	cannabinoid
+Clc1ccccc1	C6H5Cl	unknown
+FCCCCCBr	C5H10BrF	unknown
+O=C1OC(c2ccc(O)cc2)(c2ccc(O)cc2)c2ccccc21	C20H14O4	unknown
+C=CCCCCCCCCn1cc(C(=O)NC(C(N)=O)C(C)(C)C)c2cc(Br)ccc21	C25H36BrN3O2	cannabinoid
+CC(C)(C)C(NC(=O)C1=CN(Cc2ccc(F)cc2)c2ccccc2C1)C(N)=O	C23H26FN3O2	cannabinoid
+Nc1ccc(Cc2ccc(N)cc2)cc1	C13H14N2	unknown
+CCCC(C(=O)c1ccc2c(c1)CC2)N1CCCC1	C17H23NO	beta-ketone
+CC(c1ccccc1)N1CCC(n2c(=O)[nH]c3ccccc32)CC1	C20H23N3O	unknown
+CCCCCCCN1C(=O)/C(=N\NC(=O)c2ccccc2)c2ccccc21	C22H25N3O2	cannabinoid
+CCCCCc1cc(OC(C)=O)c2c(c1)OC(C)(C)[C@@H]1CCC(C)C[C@@H]21	C23H34O3	cannabinoid
+CCOc1ccc(Cc2nc3cc(C)ccc3n2CCN(CC)CC)cc1	C23H31N3O	unknown
+O=C(N/N=C1\C(=O)N(Cc2ccc(F)cc2)c2ccccc21)c1ccccc1	C22H16FN3O2	cannabinoid
+CCc1cc2c(s1)NC(=O)CN=C2c1ccccc1F	C15H13FN2OS	cannabinoid
+CCNC1(c2ccccc2F)CCCCC1=O	C14H18FNO	arylcycloalkylamine
+CC(C)(C)[C@H](NC(=O)Cc1c[nH]c2ccccc12)C(N)=O	C16H21N3O2	cannabinoid
+CC(C)(NC(=O)c1nn(S(=O)(=O)C2CCCCC2)c2ccccc12)c1ccccc1	C23H27N3O3S	cannabinoid
+COC(=O)[C@@H](NC(=O)c1n[nH]c2ccc(Br)cc12)C(C)C	C14H16BrN3O3	cannabinoid
+CC(c1ccc(I)cc1)N1CCC(n2c(=O)[nH]c3ccccc32)CC1	C20H22IN3O	unknown
+CCN(c1ccccc1)C1CCN(CCc2ccccc2)CC1	C21H28N2	fentanyl
+Cc1c(Br)c(O)c(NC(=O)C2CCCCCC2)c(=O)n1Cc1ccc(F)cc1	C21H24BrFN2O3	unknown
+CCC(NC)C(=O)c1cccc2c1OCO2	C12H15NO3	beta-ketone
+CC1N=C(c2ccccc2)c2cc(Cl)ccc2NC1=O	C16H13ClN2O	aryldiazepine
+C[C@]12Cc3nonc3C[C@@H]1CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](O)CC[C@@H]12	C19H28N2O2	unknown
+CCCOc1ccc(Cc2nc3cc([N+](=O)[O-])ccc3n2CCN2CCCC2)cc1	C23H28N4O3	unknown
+COc1ccc(Cc2nc3cc([N+](=O)[O-])ccc3n2CCN2CCCC2)cc1	C21H24N4O3	unknown
+CC(C)(NC(=O)c1n[nH]c2ccccc12)c1ccccc1	C17H17N3O	cannabinoid
+CC(C)Oc1ccc(Cc2nc3cc([N+](=O)[O-])ccc3n2CCN2CCCCC2)cc1	C24H30N4O3	unknown
+CC(C)Oc1ccc(Cc2nc3cc([N+](=O)[O-])ccc3n2CCN2CCCC2)cc1	C23H28N4O3	unknown
+CCCCn1nc(C(=O)N[C@H](C(=O)OC)C(C)(C)C)c2cc(Br)ccc21	C19H26BrN3O3	cannabinoid
+CCCCC(C(=O)c1ccccc1C)N1CCCC1	C17H25NO	unknown
+COc1ccc2c(c1)c(CCN(C)C(C)C)cn2C(=O)OC(C)(C)C	C20H30N2O3	unknown
+C=CCN(CC=C)CCc1cn(C(=O)OC(C)(C)C)c2ccc(OC)cc12	C22H30N2O3	unknown
+CC(C)(C)C(NC(=O)c1n[nH]c2ccccc12)C(N)=O	C14H18N4O2	cannabinoid
+CC(C)(C)[C@H](NC(=O)Cc1nn(Cc2ccc(F)cc2)c2ccccc12)C(N)=O	C22H25FN4O2	cannabinoid
+CCCCCCCCCCn1nc(C(=O)NC(C(N)=O)C(C)(C)C)c2cc(Br)ccc21	C24H37BrN4O2	cannabinoid
+CCCCn1nc(C(=O)NC(C(N)=O)C(C)(C)C)c2cc(F)ccc21	C18H25FN4O2	cannabinoid
+O=C(Cc1c[nH]c2ccccc12)NC1CCCCC1	C16H20N2O	cannabinoid
+CCCNC(C(C)=O)c1cccc(C)c1	C13H19NO	unknown
+CCNC(=O)Cc1c(-c2ccc(C)cc2)nc2ccc(C)cn12	C19H21N3O	unknown
+CCCC(C(=O)c1ccc2c(c1)CCC2)N1CCCCC1	C19H27NO	beta-ketone
+CC(C)(NC(=O)c1nn(S(=O)(=O)C2(Cl)CCCCC2)c2ccccc12)c1ccccc1	C23H26ClN3O3S	cannabinoid
+CCCCCOc1ccc(S(=O)(=O)NC23CC4CC(CC(C4)C2)C3)c2ccccc12	C25H33NO3S	cannabinoid
+C=CCCCn1nc(C(=O)NC(C(N)=O)C(C)(C)C)c2cc(Br)ccc21	C19H25BrN4O2	cannabinoid
+Cc1ccc(CC(C)N)s1	C8H13NS	unknown
+Cc1nnc2n1-c1ccccc1C(c1ccc(Cl)cc1)=NC2	C17H13ClN4	aryldiazepine
+CNC(C)C(=O)c1c[nH]c2ccc(F)cc12	C12H13FN2O	tryptamine
+CNC(C)C(=O)c1c[nH]c2ccc(Cl)cc12	C12H13ClN2O	tryptamine
+CCCN(CCc1c[nH]c2ccc(F)cc12)C(C)C	C16H23FN2	tryptamine
+CCCN(CC)CCc1c[nH]c2cc(F)c(F)cc12	C15H20F2N2	tryptamine
+C=CCN(C)CCc1c[nH]c2ccc(F)cc12	C14H17FN2	tryptamine
+C=CCN(CCc1c[nH]c2ccc(F)cc12)C(C)CC	C17H23FN2	tryptamine
+CCCN(CCc1c[nH]c2ccc(F)cc12)C(C)CC	C17H25FN2	tryptamine
+CNC(C)C(=O)c1c[nH]c2ccc(Br)cc12	C12H13BrN2O	tryptamine
+CCCN(CCc1c[nH]c2ccc(F)cc12)C1CCC1	C17H23FN2	tryptamine
+C=CCN(CC)CCc1c[nH]c2ccc(F)cc12	C15H19FN2	tryptamine
+CCCN(CC)CCc1c[nH]c2c(F)cc(OC)cc12	C16H23FN2O	tryptamine
+CCN(C)CCc1c[nH]c2c(F)cc(F)cc12	C13H16F2N2	tryptamine
+CCN(C)CCc1c[nH]c2c(F)cc(OC)cc12	C14H19FN2O	tryptamine
+CCCN(CC)CCc1c[nH]c2c(F)c(F)c(F)cc12	C15H19F3N2	tryptamine
+CCCN(CC)CCc1c[nH]c2c(F)cc(C)cc12	C16H23FN2	tryptamine
+C=CC(C)N(C)CCc1c[nH]c2ccc(F)cc12	C15H19FN2	tryptamine
+Oc1ccc2[nH]c3c(c2c1)CCNC3c1ccccc1F	C17H15FN2O	unknown
+COc1ccc(C2NCCc3c2[nH]c2ccc(O)cc32)c(O)c1	C18H18N2O3	unknown
+COc1cc(OC)c(C2NCCc3c2[nH]c2ccc(O)cc32)cc1OC	C20H22N2O4	unknown
+Cn1ccnc1C1NCCc2c1[nH]c1ccc(O)cc21	C15H16N4O	unknown
+Oc1ccc2[nH]c3c(c2c1)CCNC3C1CCCCC1	C17H22N2O	unknown
+Clc1ccc2[nH]c3c(c2c1)CCNC3c1ccccc1Cl	C17H14Cl2N2	unknown
+Fc1ccccc1C1NCCc2c1[nH]c1ccc(Br)cc21	C17H14BrFN2	unknown
+Oc1ccc(C2NCCc3c2[nH]c2ccc(Cl)cc32)cc1	C17H15ClN2O	unknown
+Cc1ccc(C2NCCc3c2[nH]c2ccc(F)cc32)cc1	C18H17FN2	unknown
+Clc1ccc2[nH]c3c(c2c1)CCNC3c1ccc2ccccc2c1	C21H17ClN2	unknown
+Oc1ccc(C2NCCc3c2[nH]c2ccc(Cl)cc32)c(O)c1	C17H15ClN2O2	unknown
+COc1ccc(C2NCCc3c2[nH]c2ccc(Cl)cc32)c(O)c1	C18H17ClN2O2	unknown
+Cc1ccc2c3c([nH]c2n1)CN(C)[C@H](C)C3	C13H17N3	unknown
+C[C@H]1Cc2c([nH]c3ncc(F)cc23)CN1C	C12H14FN3	unknown
+Cc1cnc2[nH]c3c(c2c1)C[C@@H](C)NC3	C12H15N3	unknown
+COc1cc2c3c([nH]c2cn1)CN[C@@H](C)C3	C12H15N3O	unknown
+CN(C)CCn1c2c(c3cccnc31)OCCC2	C14H19N3O	unknown
+CN(C)CCn1c2c(c3cncnc31)OCCO2	C12H16N4O2	unknown
+CN(C)CCn1c2c(c3ccccc31)OCCCC2	C16H22N2O	unknown
+CN(C)CCn1c2c(c3ncncc31)CCCCC2	C15H22N4	unknown
+CC1=CC(=C2C=C(C)c3[nH]cc(CCN(C)C)c3C2=O)C(=O)c2c(CCN(C)C)c[nH]c21	C26H32N4O2	unknown
+CN(C)CCC1=CN=C2C=CC(=O)C(C3(CCN(C)C)C=Nc4ccc(O)cc43)=C12	C24H28N4O2	unknown
+CN(C)CCc1c[nH]c2ccc(O)c(C3(CCN(C)C)C=NC4=CC(=O)C(=O)C=C43)c12	C24H28N4O3	unknown
+CN(C)CCc1c[nH]c2ccc(O)c(C3(CCN(C)C)C=Nc4cc5nc6ccccc6nc5cc43)c12	C30H32N6O	unknown
+CN(C)CCc1c[nH]c2ccc3nc4ccccc4nc3c12	C18H18N4	unknown
+CCC(Cc1cc(OC)c(Br)cc1OC)NC(=O)OC(C)(C)C	C17H26BrNO4	unknown
+CCC(Cc1cc(OC)c(C#N)cc1OC)NC(=O)OC(C)(C)C	C18H26N2O4	unknown
+CCC(N)Cc1cc(OC)c(C#N)cc1OC	C13H18N2O2	unknown
+COc1cc(C2CC2)c(OC)cc1C=O	C12H14O3	unknown
+CCOc1cc(C=O)c(OC)cc1C(F)(F)F	C11H11F3O3	unknown
+COCc1cc(OC)c(C=O)cc1OC	C11H14O4	unknown
+CC/C(=C\c1cc(OC)c(Br)cc1OC)[N+](=O)[O-]	C12H14BrNO4	unknown
+CC/C(=C\c1cc(OC)c(I)cc1OC)[N+](=O)[O-]	C12H14INO4	unknown
+CC/C(=C\c1cc(OC)c(C2CC2)cc1OC)[N+](=O)[O-]	C15H19NO4	unknown
+CC/C(=C\c1cc(OC)c(C(F)(F)F)cc1OC)[N+](=O)[O-]	C13H14F3NO4	unknown
+CC/C(=C\c1cc(OC)c(SC)cc1OC)[N+](=O)[O-]	C13H17NO4S	unknown
+CCSc1cc(OC)c(/C=C(\CC)[N+](=O)[O-])cc1OC	C14H19NO4S	unknown
+CC/C(=C\c1cc(OC)c(COC)cc1OC)[N+](=O)[O-]	C14H19NO5	unknown
+CCCc1cc(OC)c(/C=C(\CC)[N+](=O)[O-])cc1OC	C15H21NO4	unknown
+CCC/C(=C\c1cc(OC)c(CCC)cc1OC)[N+](=O)[O-]	C16H23NO4	unknown
+CCC(N)Cc1cc(OC)c(C(F)(F)F)cc1OC	C13H18F3NO2	unknown
+CCC(N)Cc1cc(OC)c(C2CC2)cc1OC	C15H23NO2	unknown
+CCC(N)Cc1cc(OC)c(S(C)(=O)=O)cc1OC	C13H21NO4S	unknown
+CCOc1cc(CC(N)CC)c(OC)cc1C(F)(F)F	C14H20F3NO2	unknown
+CCC(N)Cc1cc(OC)c(COC)cc1OC	C14H23NO3	unknown
+COc1cc(CC(N)C2CC2)c(OC)cc1C	C14H21NO2	unknown
+CCCC(N)Cc1cc(OC)c(C)cc1OC	C14H23NO2	unknown
+CCC(N)Cc1c(OC)cc(C)cc1OC	C13H21NO2	unknown
+CCCc1cc(OC)c(CC(N)CCC)cc1OC	C16H27NO2	unknown
+Cc1ccc2[nH]ccc2c1O	C9H9NO	unknown
+CN1CCC(c2c[nH]c3cc(F)c(F)cc23)C1	C13H14F2N2	unknown
+CN(CCc1c[nH]c2ccc(F)cc12)C1CSC1	C14H17FN2S	tryptamine
+CCCN(CC)CCc1c[nH]c2ccc(F)c(F)c12	C15H20F2N2	tryptamine
+CN1CCC(c2c[nH]c3c(F)cccc23)C1	C13H15FN2	unknown
+CCCN(CC)CC(=O)c1c[nH]c2ccc(F)cc12	C15H19FN2O	tryptamine
+CCN(C)CC(=O)c1c[nH]c2ccc(F)cc12	C13H15FN2O	tryptamine
+CC(CN(C)C)c1c[nH]c2ccc(F)cc12	C13H17FN2	tryptamine
+CN1CC(c2c[nH]c3ccc(F)cc23)C1	C12H13FN2	tryptamine
+CCC(C)N(CC)CCc1c[nH]c2ccc(F)cc12	C16H23FN2	tryptamine
+CCN(CCc1c[nH]c2ccc(F)cc12)C1CCC1	C16H21FN2	tryptamine
+C#CCN(CCc1c[nH]c2ccc(F)cc12)C(C)C	C16H19FN2	tryptamine
+C=CCN(CCC)CCc1c[nH]c2ccc(F)cc12	C16H21FN2	tryptamine
+CCCN(CC)CCc1c[nH]c2cc(Cl)c(F)cc12	C15H20ClFN2	tryptamine
+CC(C1CC1)N(C)CCc1c[nH]c2ccc(F)cc12	C16H21FN2	tryptamine
+CC(C)CN(C)CCc1c[nH]c2ccc(F)cc12	C15H21FN2	tryptamine
+CCN(C)CCc1c[nH]c2cccc(F)c12	C13H17FN2	tryptamine
+CCCN(C)CCc1c[nH]c2cccc(F)c12	C14H19FN2	tryptamine
+CC(C)N(C)CCc1c[nH]c2cccc(F)c12	C14H19FN2	tryptamine
+CCCN(CC)CCc1c[nH]c2cccc(F)c12	C15H21FN2	tryptamine
+CCN(CCc1c[nH]c2cccc(F)c12)C(C)C	C15H21FN2	tryptamine
+CC(C)CN(C)CCc1c[nH]c2cccc(F)c12	C15H21FN2	tryptamine
+CN(CCc1c[nH]c2cccc(F)c12)C1CCC1	C15H19FN2	tryptamine
+C=CCN(C)CCc1c[nH]c2cccc(F)c12	C14H17FN2	tryptamine
+CC(C)CN(CCc1c[nH]c2cccc(F)c12)C(C)C	C17H25FN2	tryptamine
+CC(C)CN(CCc1c[nH]c2ccc(F)cc12)C(C)C	C17H25FN2	tryptamine
+CCCN(C)CCc1c[nH]c2c(F)cccc12	C14H19FN2	tryptamine
+CC(C)N(C)CCc1c[nH]c2c(F)cccc12	C14H19FN2	tryptamine
+CCCN(CC)CCc1c[nH]c2c(F)cccc12	C15H21FN2	tryptamine
+CCN(CCc1c[nH]c2c(F)cccc12)C(C)C	C15H21FN2	tryptamine
+CC(C)CN(C)CCc1c[nH]c2c(F)cccc12	C15H21FN2	tryptamine
+CN(CCc1c[nH]c2c(F)cccc12)C1CCC1	C15H19FN2	tryptamine
+C=CCN(C)CCc1c[nH]c2c(F)cccc12	C14H17FN2	tryptamine
+CC(C)CN(CCc1c[nH]c2c(F)cccc12)C(C)C	C17H25FN2	tryptamine
+CCN(C)CCc1c[nH]c2cc(F)c(F)cc12	C13H16F2N2	tryptamine
+CCCN(C)CCc1c[nH]c2cc(F)c(F)cc12	C14H18F2N2	tryptamine
+CC(C)N(C)CCc1c[nH]c2cc(F)c(F)cc12	C14H18F2N2	tryptamine
+CC(C)CN(C)CCc1c[nH]c2cc(F)c(F)cc12	C15H20F2N2	tryptamine
+CN(CCc1c[nH]c2cc(F)c(F)cc12)C1CCC1	C15H18F2N2	tryptamine
+C=CCN(C)CCc1c[nH]c2cc(F)c(F)cc12	C14H16F2N2	tryptamine
+CC(C)CN(CCc1c[nH]c2cc(F)c(F)cc12)C(C)C	C17H24F2N2	tryptamine
+CCCN(C)CCc1c[nH]c2c(F)cc(F)cc12	C14H18F2N2	tryptamine
+CC(C)N(C)CCc1c[nH]c2c(F)cc(F)cc12	C14H18F2N2	tryptamine
+CCCN(CC)CCc1c[nH]c2c(F)cc(F)cc12	C15H20F2N2	tryptamine
+CCN(CCc1c[nH]c2c(F)cc(F)cc12)C(C)C	C15H20F2N2	tryptamine
+CC(C)CN(C)CCc1c[nH]c2c(F)cc(F)cc12	C15H20F2N2	tryptamine
+CN(CCc1c[nH]c2c(F)cc(F)cc12)C1CCC1	C15H18F2N2	tryptamine
+C=CCN(C)CCc1c[nH]c2c(F)cc(F)cc12	C14H16F2N2	tryptamine
+CC(C)CN(CCc1c[nH]c2c(F)cc(F)cc12)C(C)C	C17H24F2N2	tryptamine
+CCN(C)CCc1c[nH]c2c(F)c(F)ccc12	C13H16F2N2	tryptamine
+CCCN(C)CCc1c[nH]c2c(F)c(F)ccc12	C14H18F2N2	tryptamine
+CC(C)N(C)CCc1c[nH]c2c(F)c(F)ccc12	C14H18F2N2	tryptamine
+CCCN(CC)CCc1c[nH]c2c(F)c(F)ccc12	C15H20F2N2	tryptamine
+CCN(CCc1c[nH]c2c(F)c(F)ccc12)C(C)C	C15H20F2N2	tryptamine
+CC(C)CN(C)CCc1c[nH]c2c(F)c(F)ccc12	C15H20F2N2	tryptamine
+CN(CCc1c[nH]c2c(F)c(F)ccc12)C1CCC1	C15H18F2N2	tryptamine
+C=CCN(C)CCc1c[nH]c2c(F)c(F)ccc12	C14H16F2N2	tryptamine
+CC(C)CN(CCc1c[nH]c2c(F)c(F)ccc12)C(C)C	C17H24F2N2	tryptamine
+CCCN(C)CCc1c[nH]c2c(F)cc(OC)cc12	C15H21FN2O	tryptamine
+COc1cc(F)c2[nH]cc(CCN(C)C(C)C)c2c1	C15H21FN2O	tryptamine
+CCN(CCc1c[nH]c2c(F)cc(OC)cc12)C(C)C	C16H23FN2O	tryptamine
+COc1cc(F)c2[nH]cc(CCN(C)CC(C)C)c2c1	C16H23FN2O	tryptamine
+COc1cc(F)c2[nH]cc(CCN(C)C3CCC3)c2c1	C16H21FN2O	tryptamine
+C=CCN(C)CCc1c[nH]c2c(F)cc(OC)cc12	C15H19FN2O	tryptamine
+COc1cc(F)c2[nH]cc(CCN(CC(C)C)C(C)C)c2c1	C18H27FN2O	tryptamine
+CCN(C)CCc1c[nH]c2c(F)cc(O)cc12	C13H17FN2O	tryptamine
+CCCN(C)CCc1c[nH]c2c(F)cc(O)cc12	C14H19FN2O	tryptamine
+CC(C)N(C)CCc1c[nH]c2c(F)cc(O)cc12	C14H19FN2O	tryptamine
+CCCN(CC)CCc1c[nH]c2c(F)cc(O)cc12	C15H21FN2O	tryptamine
+CCN(CCc1c[nH]c2c(F)cc(O)cc12)C(C)C	C15H21FN2O	tryptamine
+CC(C)CN(C)CCc1c[nH]c2c(F)cc(O)cc12	C15H21FN2O	tryptamine
+CN(CCc1c[nH]c2c(F)cc(O)cc12)C1CCC1	C15H19FN2O	tryptamine
+C=CCN(C)CCc1c[nH]c2c(F)cc(O)cc12	C14H17FN2O	tryptamine
+CC(C)CN(CCc1c[nH]c2c(F)cc(O)cc12)C(C)C	C17H25FN2O	tryptamine
+CN1CCC(c2c[nH]c3cccc(F)c23)C1	C13H15FN2	unknown
+CN1CCC(c2c[nH]c3cc(F)ccc23)C1	C13H15FN2	unknown
+CN1CCC(c2c[nH]c3ccc(F)c(F)c23)C1	C13H14F2N2	unknown
+CN1CCC(c2c[nH]c3cc(F)cc(F)c23)C1	C13H14F2N2	unknown
+CN1CCC(c2c[nH]c3c(F)cc(F)cc23)C1	C13H14F2N2	unknown
+CN1CCC(c2c[nH]c3c(F)c(F)ccc23)C1	C13H14F2N2	unknown
+CN1CCCC(c2c[nH]c3cccc(F)c23)C1	C14H17FN2	unknown
+CN1CCCC(c2c[nH]c3ccc(F)cc23)C1	C14H17FN2	unknown
+CN1CCCC(c2c[nH]c3cc(F)ccc23)C1	C14H17FN2	unknown
+CN1CCCC(c2c[nH]c3c(F)cccc23)C1	C14H17FN2	unknown
+CN1CCCC(c2c[nH]c3ccc(F)c(F)c23)C1	C14H16F2N2	unknown
+CN1CCCC(c2c[nH]c3cc(F)cc(F)c23)C1	C14H16F2N2	unknown
+CN1CCCC(c2c[nH]c3cc(F)c(F)cc23)C1	C14H16F2N2	unknown
+CN1CCCC(c2c[nH]c3c(F)cc(F)cc23)C1	C14H16F2N2	unknown
+CN1CCCC(c2c[nH]c3c(F)c(F)ccc23)C1	C14H16F2N2	unknown
+CN1CCCC1C(=O)c1c[nH]c2cccc(F)c12	C14H15FN2O	unknown
+CN1CCCC1C(=O)c1c[nH]c2cc(F)ccc12	C14H15FN2O	unknown
+CN1CCCC1C(=O)c1c[nH]c2c(F)cccc12	C14H15FN2O	unknown
+CN1CCCC1C(=O)c1c[nH]c2ccc(F)c(F)c12	C14H14F2N2O	unknown
+CN1CCCC1C(=O)c1c[nH]c2cc(F)cc(F)c12	C14H14F2N2O	unknown
+CN1CCCC1C(=O)c1c[nH]c2cc(F)c(F)cc12	C14H14F2N2O	unknown
+CN1CCCC1C(=O)c1c[nH]c2c(F)cc(F)cc12	C14H14F2N2O	unknown
+CN1CCCC1C(=O)c1c[nH]c2c(F)c(F)ccc12	C14H14F2N2O	unknown
+CN1CCCC1Cc1c[nH]c2cccc(F)c12	C14H17FN2	unknown
+CN1CCCC1Cc1c[nH]c2cc(F)ccc12	C14H17FN2	unknown
+CN1CCCC1Cc1c[nH]c2c(F)cccc12	C14H17FN2	unknown
+CN1CCCC1Cc1c[nH]c2ccc(F)c(F)c12	C14H16F2N2	unknown
+CN1CCCC1Cc1c[nH]c2cc(F)cc(F)c12	C14H16F2N2	unknown
+CN1CCCC1Cc1c[nH]c2cc(F)c(F)cc12	C14H16F2N2	unknown
+CN1CCCC1Cc1c[nH]c2c(F)cc(F)cc12	C14H16F2N2	unknown
+CN1CCCC1Cc1c[nH]c2c(F)c(F)ccc12	C14H16F2N2	unknown
+CN(C)CC(=O)c1c[nH]c2cccc(F)c12	C12H13FN2O	tryptamine
+CN(C)CC(=O)c1c[nH]c2ccc(F)cc12	C12H13FN2O	tryptamine
+CN(C)CC(=O)c1c[nH]c2c(F)cccc12	C12H13FN2O	tryptamine
+CN(C)CC(=O)c1c[nH]c2ccc(F)c(F)c12	C12H12F2N2O	tryptamine
+CN(C)CC(=O)c1c[nH]c2cc(F)cc(F)c12	C12H12F2N2O	tryptamine
+CN(C)CC(=O)c1c[nH]c2cc(F)c(F)cc12	C12H12F2N2O	tryptamine
+CN(C)CC(=O)c1c[nH]c2c(F)c(F)ccc12	C12H12F2N2O	tryptamine
+CCCN(CCC)CCc1c[nH]c2cccc(F)c12	C16H23FN2	tryptamine
+CCCN(CCC)CCc1c[nH]c2c(F)cccc12	C16H23FN2	tryptamine
+CCCN(CCC)CCc1c[nH]c2cc(F)c(F)cc12	C16H22F2N2	tryptamine
+CCN(CC)CCc1c[nH]c2c(F)cc(F)cc12	C14H18F2N2	tryptamine
+CCCN(CCC)CCc1c[nH]c2c(F)cc(F)cc12	C16H22F2N2	tryptamine
+CCN(CC)CCc1c[nH]c2c(F)c(F)ccc12	C14H18F2N2	tryptamine
+CCCN(CCC)CCc1c[nH]c2c(F)c(F)ccc12	C16H22F2N2	tryptamine
+CCN(CC)CCc1c[nH]c2c(F)cc(OC)cc12	C15H21FN2O	tryptamine
+CCCN(CCC)CCc1c[nH]c2c(F)cc(OC)cc12	C17H25FN2O	tryptamine
+CN(C)CCc1c[nH]c2c(F)cc(O)cc12	C12H15FN2O	tryptamine
+CCN(CC)CCc1c[nH]c2c(F)cc(O)cc12	C14H19FN2O	tryptamine
+CCCN(CCC)CCc1c[nH]c2c(F)cc(O)cc12	C16H23FN2O	tryptamine
+CCC(C)N(CCc1c[nH]c2ccc(F)cc12)C1CCC1	C18H25FN2	tryptamine
+CN(CCc1c[nH]c2ccc(F)cc12)C1CC1	C14H17FN2	tryptamine
+CCCN(CCc1c[nH]c2ccc(F)cc12)C1CC1	C16H21FN2	tryptamine
+CC(C)N(C)CCc1c[nH]c2ccc(F)cc12	C14H19FN2	tryptamine
+CCN(CCc1c[nH]c2ccc(F)cc12)C(C)C	C15H21FN2	tryptamine
+CCC(C)N(C)CCc1c[nH]c2ccc(F)cc12	C15H21FN2	tryptamine
+CCN(C)CCc1c[nH]c2c(F)cccc12	C13H17FN2	tryptamine
+C=CCN(CCc1c[nH]c2ccc(F)cc12)C1CCC1	C17H21FN2	tryptamine
+CN1CCC(c2c[nH]c3ccc(F)cc23)C1	C13H15FN2	unknown
+CC(C)N(CC#N)CCc1c[nH]c2ccc(F)cc12	C15H18FN3	tryptamine
+CCCN(CCc1c[nH]c2c(F)cccc12)C(C)CC	C17H25FN2	tryptamine
+CCN(C)CCc1c[nH]c2c(F)c(F)c(F)cc12	C13H15F3N2	tryptamine
+CCN(CCc1c[nH]c2ccc(F)cc12)C1CC1	C15H19FN2	tryptamine
+CC(C)N(CCc1c[nH]c2ccc(F)cc12)C1CC1	C16H21FN2	tryptamine
+CCN(C)CCc1c[nH]c2c(C)cc(F)cc12	C14H19FN2	tryptamine
+CCN1CCCC1Cc1c[nH]c2ccc(F)cc12	C15H19FN2	unknown
+CC(C)C(C)N(C)CCc1c[nH]c2ccc(F)cc12	C16H23FN2	tryptamine
+CCC(C)N(CCc1c[nH]c2ccc(F)cc12)C1CC1	C17H23FN2	tryptamine
+Fc1ccc2[nH]cc(CCN(C3CCC3)C3CC3)c2c1	C17H21FN2	tryptamine
+CCN(C)CCc1c[nH]c2c(Br)cc(F)cc12	C13H16BrFN2	tryptamine
+CCN(C)CCc1c[nH]c2cc(C)c(F)cc12	C14H19FN2	tryptamine
+C#CCN(CCc1c[nH]c2ccc(F)cc12)C(C)CC	C17H21FN2	tryptamine
+CCC(C)N(CC#N)CCc1c[nH]c2ccc(F)cc12	C16H20FN3	tryptamine
+CCN(C)CCc1c[nH]c2cc(F)c(Cl)cc12	C13H16ClFN2	tryptamine
+C#CCN(CCC)CCc1c[nH]c2c(F)cccc12	C16H19FN2	tryptamine
+CCCN(CC#N)CCc1c[nH]c2c(F)cccc12	C15H18FN3	tryptamine
+CCN(C)CCc1c[nH]c2c(Cl)cc(F)cc12	C13H16ClFN2	tryptamine
+Fc1ccc2[nH]cc(CC3CCCN3)c2c1	C13H15FN2	unknown
+CCCN1CCCC1Cc1c[nH]c2ccc(F)cc12	C16H21FN2	unknown
+CC(CN)c1c[nH]c2ccc(F)cc12	C11H13FN2	tryptamine
+CCCN(CCc1c[nH]c2c(F)c(F)c(F)cc12)C(C)C	C16H21F3N2	tryptamine
+CCC(C)N(C)CCc1c[nH]c2c(F)c(F)c(F)cc12	C15H19F3N2	tryptamine
+CN(CCc1c[nH]c2c(F)c(F)c(F)cc12)C1CCC1	C15H17F3N2	tryptamine
+CCCN(CCc1c[nH]c2c(F)cc(OC)cc12)C(C)C	C17H25FN2O	tryptamine
+CCC(C)N(C)CCc1c[nH]c2c(F)cc(OC)cc12	C16H23FN2O	tryptamine
+C=CC(C)N(C)CCc1c[nH]c2c(F)cc(OC)cc12	C16H21FN2O	tryptamine
+C=CC(C)N(C)CCc1c[nH]c2cc(F)c(F)cc12	C15H18F2N2	tryptamine
+C=CC(C)N(C)CCc1c[nH]c2c(F)c(F)ccc12	C15H18F2N2	tryptamine
+C=CC(C)N(C)CCc1c[nH]c2c(F)cc(F)cc12	C15H18F2N2	tryptamine
+C=CC(C)N(C)CCc1c[nH]c2c(F)c(F)c(F)cc12	C15H17F3N2	tryptamine
+CCC(C)N1CCCC1Cc1c[nH]c2ccc(F)cc12	C17H23FN2	unknown
+CC(C)N1CCCC1Cc1c[nH]c2ccc(F)cc12	C16H21FN2	unknown
+Fc1ccc2[nH]cc(CC3CCCN3C3CCC3)c2c1	C17H21FN2	unknown
+Fc1ccc2[nH]cc(CC3CCCN3C3CC3)c2c1	C16H19FN2	unknown
+C=CCN1CCCC1Cc1c[nH]c2ccc(F)cc12	C16H19FN2	unknown
+C=CC(C)N1CCCC1Cc1c[nH]c2ccc(F)cc12	C17H21FN2	unknown
+C#CCN1CCCC1Cc1c[nH]c2ccc(F)cc12	C16H17FN2	unknown
+CCC(C)N1CCCC1Cc1c[nH]c2c(F)c(F)c(F)cc12	C17H21F3N2	unknown
+CC(C)N1CCCC1Cc1c[nH]c2c(F)c(F)c(F)cc12	C16H19F3N2	unknown
+Fc1cc2c(CC3CCCN3C3CCC3)c[nH]c2c(F)c1F	C17H19F3N2	unknown
+Fc1cc2c(CC3CCCN3C3CC3)c[nH]c2c(F)c1F	C16H17F3N2	unknown
+C=CCN1CCCC1Cc1c[nH]c2c(F)c(F)c(F)cc12	C16H17F3N2	unknown
+C=CC(C)N1CCCC1Cc1c[nH]c2c(F)c(F)c(F)cc12	C17H19F3N2	unknown
+C#CCN1CCCC1Cc1c[nH]c2c(F)c(F)c(F)cc12	C16H15F3N2	unknown
+CCC(C)N1CCCC1Cc1c[nH]c2c(F)cc(OC)cc12	C18H25FN2O	unknown
+COc1cc(F)c2[nH]cc(CC3CCCN3C(C)C)c2c1	C17H23FN2O	unknown
+COc1cc(F)c2[nH]cc(CC3CCCN3C3CCC3)c2c1	C18H23FN2O	unknown
+COc1cc(F)c2[nH]cc(CC3CCCN3C3CC3)c2c1	C17H21FN2O	unknown
+C=CCN1CCCC1Cc1c[nH]c2c(F)cc(OC)cc12	C17H21FN2O	unknown
+C=CC(C)N1CCCC1Cc1c[nH]c2c(F)cc(OC)cc12	C18H23FN2O	unknown
+C#CCN1CCCC1Cc1c[nH]c2c(F)cc(OC)cc12	C17H19FN2O	unknown
+CN(C)CCc1c[nH]c2c(F)ccc(OCc3ccccc3)c12	C19H21FN2O	tryptamine
+CN(C)CCc1cn(C)c2c(F)ccc(OCc3ccccc3)c12	C20H23FN2O	tryptamine
+CCn1cc(CCN(C)C)c2c(OCc3ccccc3)ccc(F)c21	C21H25FN2O	tryptamine
+CCCn1cc(CCN(C)C)c2c(OCc3ccccc3)ccc(F)c21	C22H27FN2O	tryptamine
+CN(C)CCc1cn(CCF)c2c(F)ccc(OCc3ccccc3)c12	C21H24F2N2O	tryptamine
+CCCCn1cc(CCN(C)C)c2c(OCc3ccccc3)ccc(F)c21	C23H29FN2O	tryptamine
+CN(C)CCc1cn(CC2CC2)c2c(F)ccc(OCc3ccccc3)c12	C23H27FN2O	tryptamine
+CC(C)n1cc(CCN(C)C)c2c(OCc3ccccc3)ccc(F)c21	C22H27FN2O	tryptamine
+CN(C)CCc1cn(S(C)(=O)=O)c2c(F)ccc(OCc3ccccc3)c12	C20H23FN2O3S	tryptamine
+CCS(=O)(=O)n1cc(CCN(C)C)c2c(OCc3ccccc3)ccc(F)c21	C21H25FN2O3S	tryptamine
+CN(C)CCc1cn(C)c2c(F)ccc(O)c12	C13H17FN2O	tryptamine
+CCn1cc(CCN(C)C)c2c(O)ccc(F)c21	C14H19FN2O	tryptamine
+CCCn1cc(CCN(C)C)c2c(O)ccc(F)c21	C15H21FN2O	tryptamine
+CN(C)CCc1cn(CCF)c2c(F)ccc(O)c12	C14H18F2N2O	tryptamine
+CCCCn1cc(CCN(C)C)c2c(O)ccc(F)c21	C16H23FN2O	tryptamine
+CN(C)CCc1cn(CC2CC2)c2c(F)ccc(O)c12	C16H21FN2O	tryptamine
+CC(C)n1cc(CCN(C)C)c2c(O)ccc(F)c21	C15H21FN2O	tryptamine
+CN(C)CCc1cn(S(C)(=O)=O)c2c(F)ccc(O)c12	C13H17FN2O3S	tryptamine
+CCS(=O)(=O)n1cc(CCN(C)C)c2c(O)ccc(F)c21	C14H19FN2O3S	tryptamine
+C=CCn1cc(CCN(C)C)c2c(O)ccc(F)c21	C15H19FN2O	tryptamine
+CN(C)CCc1cn(C)c2c(F)ccc(OP(=O)(O)O)c12	C13H18FN2O4P	tryptamine
+CCCn1cc(CCN(C)C)c2c(OP(=O)(O)O)ccc(F)c21	C15H22FN2O4P	tryptamine
+CN(C)CCc1c[nH]c2cc(F)cc(OCc3ccccc3)c12	C19H21FN2O	tryptamine
+CCCn1cc(CCN(C)C)c2c(OCc3ccccc3)cc(F)cc21	C22H27FN2O	tryptamine
+CCCCn1cc(CCN(C)C)c2c(OCc3ccccc3)cc(F)cc21	C23H29FN2O	tryptamine
+CN(C)CCc1cn(CC2CC2)c2cc(F)cc(OCc3ccccc3)c12	C23H27FN2O	tryptamine
+CC(C)n1cc(CCN(C)C)c2c(OCc3ccccc3)cc(F)cc21	C22H27FN2O	tryptamine
+CN(C)CCc1cn(S(C)(=O)=O)c2cc(F)cc(OCc3ccccc3)c12	C20H23FN2O3S	tryptamine
+CCS(=O)(=O)n1cc(CCN(C)C)c2c(OCc3ccccc3)cc(F)cc21	C21H25FN2O3S	tryptamine
+CN(C)CCc1cn(C)c2cc(F)cc(O)c12	C13H17FN2O	tryptamine
+CCn1cc(CCN(C)C)c2c(O)cc(F)cc21	C14H19FN2O	tryptamine
+CCCn1cc(CCN(C)C)c2c(O)cc(F)cc21	C15H21FN2O	tryptamine
+CCCCn1cc(CCN(C)C)c2c(O)cc(F)cc21	C16H23FN2O	tryptamine
+CN(C)CCc1cn(CC2CC2)c2cc(F)cc(O)c12	C16H21FN2O	tryptamine
+CN(C)CCc1cn(S(C)(=O)=O)c2cc(F)cc(O)c12	C13H17FN2O3S	tryptamine
+CCS(=O)(=O)n1cc(CCN(C)C)c2c(O)cc(F)cc21	C14H19FN2O3S	tryptamine
+CCCCCn1cc(C(=O)N[C@H](C)c2ccccc2)c2ccccc21	C22H26N2O	cannabinoid
+C[C@H](NC(=O)c1cn(CCCCCF)c2ccccc12)c1ccccc1	C22H25FN2O	cannabinoid
+C[C@@H](NC(=O)c1cn(CCCCCF)c2ccccc12)c1ccccc1	C22H25FN2O	cannabinoid
+O=C(NCc1ccccc1)c1cn(CC2CCCCC2)c2ccccc12	C23H26N2O	cannabinoid
+O=C(NCc1ccccc1)c1cn(Cc2ccc(F)cc2)c2ccccc12	C23H19FN2O	cannabinoid
+C[C@H](NC(=O)c1cn(CC2CCCCC2)c2ccccc12)c1ccccc1	C24H28N2O	cannabinoid
+C[C@@H](NC(=O)c1cn(CC2CCCCC2)c2ccccc12)c1ccccc1	C24H28N2O	cannabinoid
+C[C@H](NC(=O)c1cn(Cc2ccc(F)cc2)c2ccccc12)c1ccccc1	C24H21FN2O	cannabinoid
+C[C@@H](NC(=O)c1cn(Cc2ccc(F)cc2)c2ccccc12)c1ccccc1	C24H21FN2O	cannabinoid
+COc1cc(CCN)cc(OC)c1SCCCCO	C14H23NO3S	unknown
+CCCCSc1c(OC)cc(CCN)c(Br)c1OC	C14H22BrNO2S	unknown
+COc1cc(CC(C)N)c(OC)cc1CCCCF	C15H24FNO2	unknown
+CCCCCc1cc(OC)c(CCN)cc1OC	C15H25NO2	unknown
+CCCCCc1cc(OC)c(CC(N)CC)cc1OC	C17H29NO2	unknown
+CCCCCc1c(OC)cc(CCN)cc1OC	C15H25NO2	unknown
+CCCCSc1c(OC)cc(CCNCc2ccccc2OC)cc1OC	C22H31NO3S	unknown
+CCCCCc1c(OC)cc(CC(C)N)cc1OC	C16H27NO2	unknown
+CCCCSc1c(OC)cc(CC(C)N)cc1OC	C15H25NO2S	unknown
+CCCCCc1cc(OC)c(CCNCc2ccccc2OC)cc1OC	C23H33NO3	unknown
+CCCCCc1cc(OC)c(CC(C)NCc2ccccc2OC)cc1OC	C24H35NO3	unknown
+COc1cc(CCNCc2ccccc2)c(OC)cc1C	C18H23NO2	unknown
+COc1cc(CC(C)NCc2ccccc2OC)c(OC)cc1C	C20H27NO3	unknown
+COc1cc(CC(C)NCc2ccccc2O)c(OC)cc1C	C19H25NO3	unknown
+CCC(Cc1cc(OC)c(C)cc1OC)NCc1ccccc1OC	C21H29NO3	unknown
+COc1cc(CC(C)NCc2ccccc2OC)c(OC)cc1C#N	C20H24N2O3	unknown
+COc1cc(CC(C)NCc2ccccc2O)c(OC)cc1C#N	C19H22N2O3	unknown
+COc1cc(CC(C)N)c(OC)cc1CCCCCF	C16H26FNO2	unknown
+COc1cc(CC(C)N)c(OC)cc1CCC(C)C	C16H27NO2	unknown
+COc1cc(CC(C)N)c(OC)cc1CCCC(C)C	C17H29NO2	unknown
+COc1cc(CC(C)N)c(OC)cc1CCCC(F)(F)F	C15H22F3NO2	unknown
+CCCCCCc1cc(OC)c(CCN)cc1OC	C16H27NO2	unknown
+COc1cc(CCCCF)c(OC)cc1CCN	C14H22FNO2	unknown
+CCCCCCc1cc(OC)c(CC(N)CC)cc1OC	C18H31NO2	unknown
+CCCCSc1cc(OC)c(CC(N)CC)cc1OC	C16H27NO2S	unknown
+CCC(N)Cc1cc(OC)c(CCCCF)cc1OC	C16H26FNO2	unknown
+CCCCCc1cc(OC)c(CC(N)CO)cc1OC	C16H27NO3	unknown
+CCCCCSc1c(OC)cc(CCN)cc1OC	C15H25NO2S	unknown
+COc1cc(CCN)cc(OC)c1SCCCC(C)C	C16H27NO2S	unknown
+COc1cc(CCN)cc(OC)c1SCCC(C)C	C15H25NO2S	unknown
+COc1cc(CCN)cc(OC)c1SCCCCF	C14H22FNO2S	unknown
+CCCCSc1c(OC)cc(CC(N)CC)cc1OC	C16H27NO2S	unknown
+CCCCCc1c(OC)cc(CCNCc2ccccc2OC)cc1OC	C23H33NO3	unknown
+CCCCSc1c(OC)cc(CCNCc2ccccc2O)cc1OC	C21H29NO3S	unknown
+CCCCCSc1c(OC)cc(CCNCc2ccccc2OC)cc1OC	C23H33NO3S	unknown
+CCCCSc1c(OC)cc(CC(C)NCc2ccccc2OC)cc1OC	C23H33NO3S	unknown
+CCCCCCc1cc(OC)c(CC(C)NCc2ccccc2OC)cc1OC	C25H37NO3	unknown
+CCCCSc1cc(OC)c(CC(C)NCc2ccccc2OC)cc1OC	C23H33NO3S	unknown
+CCCCCc1cc(OC)c(CC(C)NCc2ccccc2O)cc1OC	C23H33NO3	unknown
+CCCCCc1cc(OC)c(CC(CC)NCc2ccccc2OC)cc1OC	C25H37NO3	unknown
+CCCc1cc(OC)c(CCNCc2ccccc2)cc1OC	C20H27NO2	unknown
+COc1cc(CCNCc2ccccc2)c(OC)cc1C#N	C18H20N2O2	unknown
+COc1cc(CC(C)NCc2cccc3c2OCO3)c(OC)cc1C#N	C20H22N2O4	unknown
+CCCc1cc(OC)c(CC(C)NCc2ccccc2OC)cc1OC	C22H31NO3	unknown
+CCCc1cc(OC)c(CC(CC)NCc2ccccc2OC)cc1OC	C23H33NO3	unknown
+CCCCSc1c(OC)cc(CCN)c(C)c1OC	C15H25NO2S	unknown
+CCCCCc1c(OC)cc(CC(C)N)c(OC)c1C	C17H29NO2	unknown
+CCCc1ccc(CC(C)N)c(OC)c1	C13H21NO	unknown
+CCCc1ccc(CCN)c(OC)c1	C12H19NO	unknown
+CCSc1ccc(CC(C)N)c(OC)c1	C12H19NOS	unknown
+CCCCCc1ccc(CC(C)N)c(OC)c1	C15H25NO	unknown
+COc1cc(CC(C)N)c(OC)cc1CCCCCCF	C17H28FNO2	unknown
+COc1cc(CC(C)N)c(OC)cc1CCCCC(F)(F)F	C16H24F3NO2	unknown
+CCC(N)Cc1cc(OC)c(SCCCCCF)cc1OC	C17H28FNO2S	unknown
+CCC(N)Cc1cc(OC)c(SCCCCC(F)(F)F)cc1OC	C17H26F3NO2S	unknown
+CCC(N)Cc1cc(OC)c(CCCCCCF)cc1OC	C18H30FNO2	unknown
+CCC(N)Cc1cc(OC)c(CCCC(F)(F)F)cc1OC	C16H24F3NO2	unknown
+CCC(N)Cc1cc(OC)c(CCCCC(F)(F)F)cc1OC	C17H26F3NO2	unknown
+COc1cc(CCN)cc(OC)c1SCCCCCF	C15H24FNO2S	unknown
+COc1cc(CCN)cc(OC)c1SCCCC(F)(F)F	C14H20F3NO2S	unknown
+COc1cc(CCN)cc(OC)c1SCCCCC(F)(F)F	C15H22F3NO2S	unknown
+CCC(N)Cc1cc(OC)c(SCCCCF)c(OC)c1	C16H26FNO2S	unknown
+CCC(N)Cc1cc(OC)c(SCCCC(F)(F)F)c(OC)c1	C16H24F3NO2S	unknown
+COc1cc(SCCCCCF)c(OC)cc1CC(C)N	C16H26FNO2S	unknown
+COc1cc(SCCCCCF)c(OC)cc1CCN	C15H24FNO2S	unknown
+COc1cc(CCCCCCF)c(OC)cc1CCN	C16H26FNO2	unknown
+COc1cc(CCCCC(F)(F)F)c(OC)cc1CCN	C15H22F3NO2	unknown
+CCC(N)Cc1cc(OC)c(CCCCCF)cc1OC	C17H28FNO2	unknown
+CCOCCc1cc(OC)c(CC(N)CC)cc1OC	C16H27NO3	unknown
+CCCOCc1cc(OC)c(CC(N)CC)cc1OC	C16H27NO3	unknown
+CCCCCSc1cc(OC)c(CC(N)CC)cc1OC	C17H29NO2S	unknown
+CC(C)(C)[C@H](NC(=O)c1nn(CCCCF)c2ccccc12)C(N)=O	C18H25FN4O2	cannabinoid
+NC(=O)[C@H](Cc1ccccc1)NC(=O)c1nn(CCCCF)c2ccccc12	C21H23FN4O2	cannabinoid
+CC(C)[C@H](NC(=O)c1cn(CCCCF)c2ncccc12)C(N)=O	C17H23FN4O2	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1cn(CCCCF)c2ncccc12)C(N)=O	C18H25FN4O2	cannabinoid
+NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cn(CCCCF)c2ncccc12	C21H23FN4O2	cannabinoid
+COC(=O)[C@@H](NC(=O)c1cn(CCCCF)c2ccccc12)C(C)C	C19H25FN2O3	cannabinoid
+COC(=O)[C@H](Cc1ccccc1)NC(=O)c1cn(CCCCF)c2ccccc12	C23H25FN2O3	cannabinoid
+COC(=O)[C@@H](NC(=O)c1nn(CCCCF)c2ccccc12)C(C)C	C18H24FN3O3	cannabinoid
+COC(=O)[C@H](Cc1ccccc1)NC(=O)c1nn(CCCCF)c2ccccc12	C22H24FN3O3	cannabinoid
+COC(=O)[C@@H](NC(=O)c1cn(CCCCF)c2ncccc12)C(C)C	C18H24FN3O3	cannabinoid
+COC(=O)[C@@H](NC(=O)c1cn(CCCCF)c2ncccc12)C(C)(C)C	C19H26FN3O3	cannabinoid
+COC(=O)[C@H](Cc1ccccc1)NC(=O)c1cn(CCCCF)c2ncccc12	C22H24FN3O3	cannabinoid
+CCCCCn1cc(C(=O)NC2CCCCC2)c2ccccc21	C20H28N2O	cannabinoid
+Cc1ccc(C2CC(N(C)C)Cc3ccccc32)cc1	C19H23N	unknown
+Cn1ccc2cc3c(cc21)CCN3C(=O)Nc1ccccn1	C17H16N4O	unknown
+O=C1Nc2cc(Cl)c(Cl)cc2N2CCNCC12	C11H11Cl2N3O	unknown
+CC(C)[C@H](NC(=O)c1nn(CCCCF)c2ccccc12)C(N)=O	C17H23FN4O2	cannabinoid
+CNCCc1c[nH]c2cccc(OC(C)=O)c12	C13H16N2O2	tryptamine
+CC1C=C(c2cnn(C)c2)CN(CC2(C)COC2)C1	C15H23N3O	unknown
+CCc1cncn1CCN1CC(c2ccn(C)c2)=CC(C)C1	C18H26N4	unknown
+CCCCCN1CC(c2cnn(C)c2)=CC(C)C1	C15H25N3	unknown
+Cc1cncc(C2=CC(C)CN(CC3(O)COC3)C2)c1	C16H22N2O2	unknown
+CC1C=C(c2cncc(Cl)c2)CN(CC2(O)COC2)C1	C15H19ClN2O2	unknown
+CCCCCN1CC(c2cncc(Cl)c2)=CC(C)C1	C16H23ClN2	unknown
+CCCCN1CC(c2cncc(Cl)c2)=CC(C)C1	C15H21ClN2	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(CCCF)C1	C22H28FN3O	unknown
+CCCN1C[C@H](C(=O)N[C@@H](C)CC)C=C2c3cccc4[nH]cc(c34)C[C@H]21	C22H29N3O	unknown
+CCCN1C[C@H](C(=O)N2[C@@H](C)C[C@@H]2C)C=C2c3cccc4[nH]cc(c34)C[C@H]21	C23H29N3O	unknown
+CC[C@H](C)NC(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(CC)C1	C21H27N3O	unknown
+CCCN1C[C@H](C(=O)NC(CC)CC)C=C2c3cccc4[nH]cc(c34)C[C@H]21	C23H31N3O	unknown
+CCC[C@H](C)NC(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(CCC)C1	C23H31N3O	unknown
+C=CCN1C[C@H](C(=O)N[C@@H](C)CC)C=C2c3cccc4[nH]cc(c34)C[C@H]21	C22H27N3O	unknown
+CCCN1C[C@H](C(=O)N(CC)CC)C=C2c3cccc4[nH]c(Br)c(c34)C[C@H]21	C22H28BrN3O	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(Cc2ccccc2OC)C1	C27H31N3O2	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(CCc2ccccc2OC)C1	C28H33N3O2	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(CCC(F)(F)F)C1	C22H26F3N3O	unknown
+CCCN1C[C@H](C(=O)N2CCCC2)C=C2c3cccc4[nH]cc(c34)C[C@H]21	C22H27N3O	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(Cc2ccccc2O)C1	C26H29N3O2	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(Cc2cccc(OC)c2)C1	C27H31N3O2	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(Cc2ccc(OC)cc2)C1	C27H31N3O2	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(CCc2cccc(OC)c2)C1	C28H33N3O2	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(CCc2ccc(OC)cc2)C1	C28H33N3O2	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(Cc2ccccn2)C1	C25H28N4O	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(CCc2cccnc2)C1	C26H30N4O	unknown
+CC[C@H](C)NC(=O)C1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(Cc2ccccc2OC)C1	C27H31N3O2	unknown
+CC[C@H](C)NC(=O)C1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(CCc2ccccc2OC)C1	C28H33N3O2	unknown
+C[C@H]1C[C@H](C)N1C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(CCCF)C1	C23H28FN3O	unknown
+C=CCN1C[C@H](C(=O)N2[C@@H](C)C[C@@H]2C)C=C2c3cccc4[nH]cc(c34)C[C@H]21	C23H27N3O	unknown
+CCCN1C[C@H](C(=O)N(CC)CC)C=C2c3cccc4c3C(CN4)C[C@H]21	C22H31N3O	unknown
+CN1C[C@H](C(=O)N(CCF)CCF)C=C2c3cccc4[nH]cc(c34)C[C@H]21	C20H23F2N3O	unknown
+CCCCN1CC(c2cncc(C)c2)=CC(C)C1	C16H24N2	unknown
+CCCN1CC(c2cncc(Cl)c2)=CC(C)C1	C14H19ClN2	unknown
+CC1C=C(c2cncc(Cl)c2)CN(C)C1	C12H15ClN2	unknown
+CC1C=C(c2cncc(Cl)c2)CN(CCC2CCCC2)C1	C18H25ClN2	unknown
+CCCCN1CC(c2c[nH]c3ncccc23)=CC(C)C1	C17H23N3	unknown
+CCCN1CC(c2c[nH]c3ncccc23)=CC(C)C1	C16H21N3	unknown
+CC1C=C(c2c[nH]c3ncccc23)CN(CC2(C)COC2)C1	C18H23N3O	unknown
+CC1C=C(c2c[nH]c3ncccc23)CN(C2COC2)C1	C16H19N3O	unknown
+CC1C=C(c2c[nH]c3ncccc23)CN(C2CC2)C1	C16H19N3	unknown
+CC1C=C(c2c[nH]c3ncccc23)CN(CCCc2cnn(C)c2)C1	C20H25N5	unknown
+Cc1ncc(CCN2CC(c3c[nH]c4ncccc34)=C[C@H](C)C2)cn1	C20H23N5	unknown
+CC1C=C(c2c[nH]c3ncccc23)CN(CCCN(C)C)C1	C18H26N4	unknown
+CC1C=C(c2c[nH]c3ncccc23)CN(CC2CC2)C1	C17H21N3	unknown
+CC1C=C(c2c[nH]c3ncccc23)CN(Cc2cnco2)C1	C17H18N4O	unknown
+C[C@@H]1C=C(c2c[nH]c3ncccc23)CNC1	C13H15N3	unknown
+CC1C=C(c2c[nH]c3ncccc23)CN(C)C1	C14H17N3	unknown
+C1=C(c2c[nH]c3ncccc23)CNCC1	C12H13N3	unknown
+c1cnc2[nH]cc(C3CCCNC3)c2c1	C12H15N3	unknown
+CC(C)(C)[C@H](NC(=O)c1cn(CCCCC#N)c2ccccc12)C(N)=O	C20H26N4O2	cannabinoid
+N#CCCCCn1cc(C(=O)N[C@@H](Cc2ccccc2)C(N)=O)c2ccccc21	C23H24N4O2	cannabinoid
+CC(C)[C@H](NC(=O)c1nn(CCCCC#N)c2ccccc12)C(N)=O	C18H23N5O2	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1nn(CCCCC#N)c2ccccc12)C(N)=O	C19H25N5O2	cannabinoid
+N#CCCCCn1nc(C(=O)N[C@@H](Cc2ccccc2)C(N)=O)c2ccccc21	C22H23N5O2	cannabinoid
+CC(C)[C@H](NC(=O)c1cn(CCCCC#N)c2ncccc12)C(N)=O	C18H23N5O2	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1cn(CCCCC#N)c2ncccc12)C(N)=O	C19H25N5O2	cannabinoid
+N#CCCCCn1cc(C(=O)N[C@@H](Cc2ccccc2)C(N)=O)c2cccnc21	C22H23N5O2	cannabinoid
+COC(=O)[C@@H](NC(=O)c1cn(CCCCC#N)c2ccccc12)C(C)(C)C	C21H27N3O3	cannabinoid
+COC(=O)[C@H](Cc1ccccc1)NC(=O)c1cn(CCCCC#N)c2ccccc12	C24H25N3O3	cannabinoid
+COC(=O)[C@H](Cc1ccccc1)NC(=O)c1nn(CCCCC#N)c2ccccc12	C23H24N4O3	cannabinoid
+COC(=O)[C@@H](NC(=O)c1cn(CCCCC#N)c2ncccc12)C(C)(C)C	C20H26N4O3	cannabinoid
+COC(=O)[C@H](Cc1ccccc1)NC(=O)c1cn(CCCCC#N)c2ncccc12	C23H24N4O3	cannabinoid
+CC(C)[C@H](NC(=O)c1cn(CCCCF)c2ccccc12)C(N)=O	C18H24FN3O2	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1cn(CCCCF)c2ccccc12)C(N)=O	C19H26FN3O2	cannabinoid
+COc1cccc(C2(N)CCCCC2=O)c1	C13H17NO2	unknown
+COc1cc([N+](=O)[O-])c(OC)cc1CCNCc1ccccc1	C17H20N2O4	unknown
+COc1cc([N+](=O)[O-])c(OC)cc1CCNCc1ccccc1O	C17H20N2O5	unknown
+CCOc1ccccc1CNCCc1cc(OC)c([N+](=O)[O-])cc1OC	C19H24N2O5	unknown
+COc1cc([N+](=O)[O-])c(OC)cc1CCNCc1ccccc1C	C18H22N2O4	unknown
+COc1cc([N+](=O)[O-])c(OC)cc1CCNCc1ccccc1F	C17H19FN2O4	unknown
+COc1cc([N+](=O)[O-])c(OC)cc1CCNCc1ccccc1Cl	C17H19ClN2O4	unknown
+COc1cc([N+](=O)[O-])c(OC)cc1CCNCc1ccccc1Br	C17H19BrN2O4	unknown
+COc1cc([N+](=O)[O-])c(OC)cc1CCNCc1ccccc1I	C17H19IN2O4	unknown
+COc1cc([N+](=O)[O-])c(OC)cc1CCNCc1ccccc1OC(F)F	C18H20F2N2O5	unknown
+COc1cc([N+](=O)[O-])c(OC)cc1CCNCc1ccccc1OC(F)(F)F	C18H19F3N2O5	unknown
+COc1cc([N+](=O)[O-])c(OC)cc1CCNCc1cccc2c1OC(F)(F)O2	C18H18F2N2O6	unknown
+COc1cc([N+](=O)[O-])c(OC)cc1CCNCc1ccccc1C(F)(F)F	C18H19F3N2O4	unknown
+COc1cc([N+](=O)[O-])c(OC)cc1CCNCc1ccccc1[N+](=O)[O-]	C17H19N3O6	unknown
+COc1cc([N+](=O)[O-])c(OC)cc1CCNCc1cccc2ccccc12	C21H22N2O4	unknown
+COc1cc([N+](=O)[O-])c(OC)cc1CCNCc1ccccc1-c1ccccc1	C23H24N2O4	unknown
+COc1cc([N+](=O)[O-])c(OC)cc1CCNCc1cccc(C)c1O	C18H22N2O5	unknown
+COc1cc([N+](=O)[O-])c(OC)cc1CCNCc1cccc(F)c1OC	C18H21FN2O5	unknown
+COc1ccc(OC)c(CNCCc2cc(OC)c([N+](=O)[O-])cc2OC)c1	C19H24N2O6	unknown
+COc1cc([N+](=O)[O-])c(OC)cc1CCNCc1cccc(O)c1	C17H20N2O5	unknown
+COc1cc([N+](=O)[O-])c(OC)cc1CCNCc1cccc(C)c1	C18H22N2O4	unknown
+COc1cc([N+](=O)[O-])c(OC)cc1CCNCc1ccc(C)cc1	C18H22N2O4	unknown
+COc1cc([N+](=O)[O-])c(OC)cc1CCNCc1cccc(F)c1	C17H19FN2O4	unknown
+COc1cc([N+](=O)[O-])c(OC)cc1CCNCc1ccc(F)cc1	C17H19FN2O4	unknown
+COc1cc(CCNCc2cccc3ccccc23)c(OC)cc1C	C22H25NO2	unknown
+COc1cc(CCNCc2ccccc2-c2ccccc2)c(OC)cc1C	C24H27NO2	unknown
+Brc1c2c(c(CCNCc3cccc4ccccc34)c3c1OCC3)OCC2	C23H22BrNO2	unknown
+COc1cc(Br)c(CCNCc2cccc3ccccc23)cc1OC	C21H22BrNO2	unknown
+COc1cc(CCNCc2cccc3ccccc23)cc(OC)c1Br	C21H22BrNO2	unknown
+COc1cc(Br)cc(OC)c1CCNCc1cccc2ccccc12	C21H22BrNO2	unknown
+COc1cc(Br)cc(OC)c1CC(C)NCc1cccc2ccccc12	C22H24BrNO2	unknown
+COc1cc(Cl)ccc1CCNCc1cccc2ccccc12	C20H20ClNO	unknown
+COc1cc(Br)c(Br)c(OC)c1CCNCc1cccc2ccccc12	C21H21Br2NO2	unknown
+COc1cc(Br)ccc1CCNCc1cccc2ccccc12	C20H20BrNO	unknown
+CCOc1ccc(CCNCc2cccc3ccccc23)cc1OC	C22H25NO2	unknown
+COc1cc(OC)c(OC)cc1CCNCc1cccc2ccccc12	C22H25NO3	unknown
+COc1cc2c(cc1CCNCc1cccc3ccccc13)OCO2	C21H21NO3	unknown
+COc1cc(CCNCc2cccc3ccccc23)ccc1Cl	C20H20ClNO	unknown
+COc1cc(Br)ccc1CCNCc1cccc(C)c1O	C17H20BrNO2	unknown
+COc1cc(Br)cc(OC)c1CCNCc1cccc(C)c1O	C18H22BrNO3	unknown
+COc1cc(Br)c(CCNCc2cccc(C)c2O)cc1OC	C18H22BrNO3	unknown
+COc1cc(CCNCc2cccc(C)c2O)cc(OC)c1Br	C18H22BrNO3	unknown
+COc1cc(Br)c(Br)c(OC)c1CCNCc1cccc(C)c1O	C18H21Br2NO3	unknown
+COc1cc(Cl)ccc1CCNCc1cccc(C)c1O	C17H20ClNO2	unknown
+COc1cc(CCNCc2cccc(C)c2O)ccc1Cl	C17H20ClNO2	unknown
+COc1cc(OC)c(OC)cc1CCNCc1cccc(Br)c1O	C18H22BrNO4	unknown
+COc1cc(OC)c(OC)cc1CCNCc1cccc(I)c1O	C18H22INO4	unknown
+COc1cc(OC)c(OC)cc1CCNCc1cccc(C)c1C	C20H27NO3	unknown
+COc1cc(OC)c(OC)cc1CCNCc1cccc2c1CCC2	C21H27NO3	unknown
+COc1cc(OC)c(OC)cc1CCNCc1cccc2c1CCCC2	C22H29NO3	unknown
+COc1cc(OC)c(OC)cc1CCNCc1cccc(I)c1	C18H22INO3	unknown
+COc1cc(OC)c(OC)cc1CCNCc1cccc2cccnc12	C21H24N2O3	unknown
+COc1cc(OC)c(OC)cc1CCNCc1cccc2ccncc12	C21H24N2O3	unknown
+COc1cc(OC)c(OC)cc1CCNCc1cccc2cnccc12	C21H24N2O3	unknown
+COc1cc(OC)c(OC)cc1CCNCc1cccc2ncccc12	C21H24N2O3	unknown
+COc1cc(OC)c(OC)cc1CCNCc1ccccc1-c1ccco1	C22H25NO4	unknown
+COc1cc(OC)c(OC)cc1CCNCc1ccccc1-c1cccs1	C22H25NO3S	unknown
+COc1cc(OC)c(OC)cc1CCNCc1ccccc1Oc1ccccc1	C24H27NO4	unknown
+COc1cc(OC)c(OC)cc1CCNCc1ccccc1OCc1ccccc1	C25H29NO4	unknown
+COc1cc(OC)c(OC)cc1CCNCc1cccc(-c2ccccc2)c1	C24H27NO3	unknown
+COc1cc(OC)c(OC)cc1CCNCc1cccc(-c2ccccc2)c1O	C24H27NO4	unknown
+COc1cc(OC)c(OC)cc1CCNCc1ccccc1-c1ccc(O)cc1	C24H27NO4	unknown
+COc1cc(OC)c(OC)cc1CCNCc1cccc(F)c1F	C18H21F2NO3	unknown
+COc1cc(OC)c(OC)cc1CCNC(C)c1cccc2ccccc12	C23H27NO3	unknown
+COc1cc(OC)c(OC)cc1CCNCc1ccc(F)c2ccccc12	C22H24FNO3	unknown
+COc1cc(OC)c(OC)cc1CCNCc1ccccc1C(C)C	C21H29NO3	unknown
+COc1cc(OC)c(OC)cc1CCNCc1ccccc1C1CC1	C21H27NO3	unknown
+COc1cc(OC)c(OC)cc1CCNCc1cccc(C(C)(C)C)c1	C22H31NO3	unknown
+COc1cc(OC)c(OC)cc1CCNCc1cccc(I)c1F	C18H21FINO3	unknown
+COc1cc(OC)c(OC)cc1CCNCc1cccc2ccsc12	C20H23NO3S	unknown
+COc1cc(OC)c(OC)cc1CCNCc1cccc2c1oc1ccccc12	C24H25NO4	unknown
+COc1cc(OC)c(OC)cc1CCNCc1ccc(-c2ccccc2)o1	C22H25NO4	unknown
+COc1cc(OC)c(OC)cc1CCNCc1ccc(-c2ccccc2)s1	C22H25NO3S	unknown
+COc1cc(OC)c(OC)cc1CCNCc1ccc(-c2cccs2)s1	C20H23NO3S2	unknown
+COc1cc(OC)c(OC)cc1CCNCc1cccc(OCc2ccccc2)c1	C25H29NO4	unknown
+COc1cccc(COc2ccccc2CNCCc2cc(OC)c(OC)cc2OC)c1	C26H31NO5	unknown
+COc1cc(OC)c(OC)cc1CCNCc1c[nH]nc1-c1ccccc1	C21H25N3O3	unknown
+COc1cc(OC)c(OC)cc1CCNCc1ccccc1SC(C)(C)C	C22H31NO3S	unknown
+COc1cc(OC)c(OC)cc1CCNCc1ccccc1-c1cccnc1	C23H26N2O3	unknown
+COc1cc(OC)c(OC)cc1CCNCc1cccc(C)c1O	C19H25NO4	unknown
+NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cn(CCCCF)c2ccccc12	C22H24FN3O2	cannabinoid
+O=c1[nH]c2ccccc2c(=O)n1CCNCCc1ccccc1	C18H19N3O2	unknown
+O=c1[nH]c2ccccc2c(=O)n1CCNCCCc1ccccc1	C19H21N3O2	unknown
+CN1CCNC(c2ccccc2)C1	C11H16N2	unknown
+NC(Cc1cc(O)ccc1O)C(=O)O	C9H11NO4	unknown
+CCOc1cc(OCC)c(C=O)c(OCC)c1	C13H18O4	unknown
+CCOc1cc(OCC)c(/C=C/[N+](=O)[O-])c(OCC)c1	C14H19NO5	unknown
+COC1CC(CCN)CCC1O	C9H19NO2	unknown
+NCCC1CCC(O)CC1	C8H17NO	unknown
+COc1cc(/C=C/[N+](=O)[O-])cc(OC)c1O	C10H11NO5	unknown
+COc1cc(OC)c(OC)c(OC)c1C=O	C11H14O5	unknown
+COc1cc(OC)c(OC)c(OC)c1/C=C/[N+](=O)[O-]	C12H15NO6	unknown
+COc1cc(C=O)c(OC)c(OC)c1OC	C11H14O5	unknown
+COc1cc(/C=C/[N+](=O)[O-])c(OC)c(OC)c1OC	C12H15NO6	unknown
+COc1cc(OC)c(OC)c(CC#N)c1OC	C12H15NO4	unknown
+CCc1cc(CC)c(CC#N)c(CC)c1	C14H19N	unknown
+COc1cc(/C=C/[N+](=O)[O-])cc(O)c1O	C9H9NO5	unknown
+O=[N+]([O-])/C=C/c1cc2c3c(c1)CCCN3CCC2	C14H16N2O2	unknown
+CCN(CC)c1ccc(/C=C/[N+](=O)[O-])cc1	C12H16N2O2	unknown
+CN(C)CCc1cn(C)c2ccc(OCc3ccccc3)cc12	C20H24N2O	unknown
+Cc1ccc(CC#N)cc1C	C10H11N	unknown
+N#CCc1ccc(Cl)c(Cl)c1	C8H5Cl2N	unknown
+NC1CCCCCC1c1ccccc1	C13H19N	unknown
+CC(C)NC1CC1c1ccccc1	C12H17N	unknown
+CC(C)(C)OC(=O)NC1CC1c1ccccc1	C14H19NO2	unknown
+O=C(NC1CC1c1ccccc1)OCc1ccccc1	C17H17NO2	unknown
+NC1C2CC12c1ccccc1	C10H11N	unknown
+NC1C2CCC12c1ccccc1	C11H13N	unknown
+CCC/C(=C\c1cc(OC)c(OC)c(OC)c1)[N+](=O)[O-]	C14H19NO5	unknown
+CCCC/C(=C\c1cc(OC)c(OC)c(OC)c1)[N+](=O)[O-]	C15H21NO5	unknown
+CCCCC/C(=C\c1cc(OC)c(OC)c(OC)c1)[N+](=O)[O-]	C16H23NO5	unknown
+CCCCCC/C(=C\c1cc(OC)c(OC)c(OC)c1)[N+](=O)[O-]	C17H25NO5	unknown
+CCCCCCC/C(=C\c1cc(OC)c(OC)c(OC)c1)[N+](=O)[O-]	C18H27NO5	unknown
+COc1cccc(OC)c1CC#N	C10H11NO2	unknown
+CCN1CC(CCN2CCOCC2)C(c2ccccc2)(c2ccccc2)C1=O	C24H30N2O2	unknown
+CCOc1cc(OCC)c(OCC)cc1/C=C(\C)[N+](=O)[O-]	C15H21NO5	unknown
+C=CCOc1c(Cl)cc(C=O)cc1Cl	C10H8Cl2O2	unknown
+COc1c(Cl)cc(C=O)cc1Cl	C8H6Cl2O2	unknown
+COc1cc(C=O)cc(Cl)c1OC	C9H9ClO3	unknown
+COc1cc(Cl)c(C=O)cc1OC	C9H9ClO3	unknown
+COc1c(Cl)ccc(Cl)c1C=O	C8H6Cl2O2	unknown
+O=Cc1c(Cl)ccc(Cl)c1O	C7H4Cl2O2	unknown
+O=Cc1cc(Cl)c(O)cc1Cl	C7H4Cl2O2	unknown
+O=Cc1cc(Cl)c(O)c(Cl)c1	C7H4Cl2O2	unknown
+O=[N+]([O-])/C=C/c1cc2c(cc1Cl)OCO2	C9H6ClNO4	unknown
+C=CCOc1c(Cl)cc(/C=C/[N+](=O)[O-])cc1Cl	C11H9Cl2NO3	unknown
+COc1c(Cl)cc(/C=C(\C)[N+](=O)[O-])cc1Cl	C10H9Cl2NO3	unknown
+COc1cc(/C=C/[N+](=O)[O-])cc(Cl)c1OC	C10H10ClNO4	unknown
+COc1cc(/C=C(\C)[N+](=O)[O-])cc(Cl)c1OC	C11H12ClNO4	unknown
+COc1c(Cl)ccc(Cl)c1/C=C/[N+](=O)[O-]	C9H7Cl2NO3	unknown
+COc1cc(Cl)c(/C=C/[N+](=O)[O-])cc1OC	C10H10ClNO4	unknown
+COc1cccc(CC#N)c1O	C9H9NO2	unknown
+COc1cc(CC#N)ccc1O	C9H9NO2	unknown
+COc1cc(OC)c(OC)cc1CC#N	C11H13NO3	unknown
+COc1ccc(CC(C)NC(C)c2ccccc2)cc1OC	C19H25NO2	unknown
+COc1ccc(CC(C)NC(C)c2ccccc2)cc1	C18H23NO	unknown
+COc1cccc(CC(C)NC(C)c2ccccc2)c1OC	C19H25NO2	unknown
+COc1ccc(OC)c(CC(C)NC(C)c2ccccc2)c1	C19H25NO2	unknown
+COc1cc(CC(C)NC(C)c2ccccc2)cc(OC)c1OC	C20H27NO3	unknown
+COc1cc(CC(C)NC(C)c2ccccc2)c(OC)cc1C	C20H27NO2	unknown
+CCc1cc(OC)c(CC(C)NC(C)c2ccccc2)cc1OC	C21H29NO2	unknown
+NCC(O)c1cc2c(cc1O)OCO2	C9H11NO4	unknown
+COc1ccc(C(O)C#N)cc1OC	C10H11NO3	unknown
+Cc1cc(C=O)cc(C)c1O	C9H10O2	unknown
+COc1c(C)cc(C=O)cc1C	C10H12O2	unknown
+C/C(=C\c1cc(C)c(O)c(C)c1)[N+](=O)[O-]	C11H13NO3	unknown
+COc1c(C)cc(/C=C(\C)[N+](=O)[O-])cc1C	C12H15NO3	unknown
+COc1cc(C=O)cc(OC)c1C	C10H12O3	unknown
+COc1cc(/C=C(\C)[N+](=O)[O-])cc(OC)c1C	C12H15NO4	unknown
+C=C(C)[C@@H]1CCC(C)=C[C@H]1c1c(OC)cc(CCCCC)cc1OC	C23H34O2	cannabinoid
+CCCc1cc(OC)c2c(c1)OC(C)(C)c1ccc(C)cc1-2	C20H24O2	unknown
+CCCCCc1cc(OC)c2c(c1)OC(C)(CCC=C(C)C)C=C2	C22H32O2	cannabinoid
+CCCCCc1cc(OC)c2c(c1)OC(C)(C)[C@@H]1CC=C(C)C[C@@H]21	C22H32O2	cannabinoid
+CCCCCc1cc(OC)c(C/C=C(\C)CCC=C(C)C)c(OC)c1	C23H36O2	cannabinoid
+COc1cc(CC#N)c(OC)cc1C	C11H13NO2	unknown
+CC(N)(Cc1cc(O)c(O)cc1O)C(=O)O	C10H13NO5	unknown
+CC(N)(Cc1ccc(O)c(O)c1)C(=O)O	C10H13NO4	unknown
+CCOc1c(OC)cc(CC#N)cc1OC	C12H15NO3	unknown
+CCCOc1c(OC)cc(CC#N)cc1OC	C13H17NO3	unknown
+COc1cc(CC#N)cc(OC)c1OC(C)C	C13H17NO3	unknown
+CCCCOc1c(OC)cc(CC#N)cc1OC	C14H19NO3	unknown
+COc1cc(CC#N)cc(OC)c1OCc1ccccc1	C17H17NO3	unknown
+COc1cc(CC#N)cc(OC)c1Br	C10H10BrNO2	unknown
+CC1Oc2ccc(C=O)cc2O1	C9H8O3	unknown
+CC1(C)Oc2ccc(C=O)cc2O1	C10H10O3	unknown
+C/C(=C\c1ccc2c(c1)OC(C)O2)[N+](=O)[O-]	C11H11NO4	unknown
+C/C(=C\c1ccc2c(c1)OC(C)(C)O2)[N+](=O)[O-]	C12H13NO4	unknown
+CCCN(CCC)C1CCCc2ccccc2C1	C17H27N	unknown
+CC(N)C(=O)c1ccc(O)cc1	C9H11NO2	beta-ketone
+NCC(N)c1ccccc1	C8H12N2	unknown
+NCC1(O)CCCc2ccccc21	C11H15NO	unknown
+COc1ccc2c(c1)C(CN)CCO2	C11H15NO2	unknown
+COC(CN(C)C)c1ccccc1	C11H17NO	unknown
+NCCc1c[nH]c2c(Cl)cc(O)cc12	C10H11ClN2O	tryptamine
+NCCc1c[nH]c2c(O)c(O)c(O)cc12	C10H12N2O3	tryptamine
+CNCCc1c[nH]c2cccc(N)c12	C11H15N3	tryptamine
+CNCCc1c[nH]c2c(OC)cc(OC)cc12	C13H18N2O2	tryptamine
+CN(C)CCc1c[nH]c2c(O)cc(O)cc12	C12H16N2O2	tryptamine
+CCNCCc1c[nH]c2c(O)cccc12	C12H16N2O	tryptamine
+CCNCCc1c[nH]c2c(OC)cccc12	C13H18N2O	tryptamine
+CCNCCc1c[nH]c2c(OC)cc(OC)cc12	C14H20N2O2	tryptamine
+CCN(CC)CCc1c[nH]c2c(O)cc(O)cc12	C14H20N2O2	tryptamine
+CCN(CC)CCc1c[nH]c2cccc(N)c12	C14H21N3	tryptamine
+CCN(CC)CCc1c[nH]c2c(OC)cccc12	C15H22N2O	tryptamine
+CCN(CC)CCc1c[nH]c2c(OC)cc(OC)cc12	C16H24N2O2	tryptamine
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4OC)C[C@H]2N(C)C1	C21H27N3O2	unknown
+COc1cc(CC(C)NCCS)c(OC)cc1I	C13H20INO2S	unknown
+CN[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	C13H16N2O2	unknown
+N#Cc1cccc(CCN)c1N	C9H11N3	unknown
+Cc1ccc(C(=O)NCCC(C)NCC(O)c2ccc(O)c(O)c2)cc1	C20H26N2O4	unknown
+Cc1ccc(C(=O)NCCCC(C)NCC(O)c2ccc(O)c(O)c2)cc1	C21H28N2O4	unknown
+Cc1ccc(C(=O)NCCCCC(C)NCC(O)c2ccc(O)c(O)c2)cc1	C22H30N2O4	unknown
+Cc1ccc(C(=O)NCCCCCC(C)NCC(O)c2ccc(O)c(O)c2)cc1	C23H32N2O4	unknown
+Cc1ccccc1C(=O)NCCC(C)NCC(O)c1ccc(O)c(O)c1	C20H26N2O4	unknown
+Cc1ccccc1C(=O)NCCCC(C)NCC(O)c1ccc(O)c(O)c1	C21H28N2O4	unknown
+Cc1ccccc1C(=O)NCCCCC(C)NCC(O)c1ccc(O)c(O)c1	C22H30N2O4	unknown
+Cc1ccccc1C(=O)NCCCCCC(C)NCC(O)c1ccc(O)c(O)c1	C23H32N2O4	unknown
+Cc1ccc(S(=O)(=O)NCCC(C)NCC(O)c2ccc(O)c(O)c2)cc1	C19H26N2O5S	unknown
+Cc1ccc(NC(=O)NCCCCC(C)NCC(O)c2ccc(O)c(O)c2)cc1	C22H31N3O4	unknown
+CC(N)CCc1ccc(N(C)C)cc1Cl	C12H19ClN2	unknown
+Cc1cc(N(C)C)c(Br)cc1CC(C)N	C12H19BrN2	unknown
+CNc1cc(C)c(CC(C)N)cc1Br	C11H17BrN2	unknown
+CNc1cc(C)c(CC(C)N)cc1C	C12H20N2	unknown
+Cc1cc(N)c(Br)cc1CC(C)N	C10H15BrN2	unknown
+CC1NC(C(=O)O)Cc2cc(O)ccc21	C11H13NO3	unknown
+COc1ccc2c(c1)CCN(C)C2	C11H15NO	unknown
+CN1CCc2cc(O)c(O)cc2C1	C10H13NO2	unknown
+COc1cc2c(cc1O)CCN(C)C2	C11H15NO2	unknown
+COc1cc2c(cc1O)C[N+](C)(C)CC2	C12H17NO2	unknown
+O=C(O)C1Cc2cc(O)c(O)cc2CN1	C10H11NO4	unknown
+CC1NC(C(=O)O)Cc2cc(O)c(O)cc21	C11H13NO4	unknown
+CN1CCc2ccc(O)c(O)c2C1	C10H13NO2	unknown
+COc1c(O)ccc2c1CN(C)CC2	C11H15NO2	unknown
+COc1ccc2c(c1O)CN(C)CC2	C11H15NO2	unknown
+COc1ccc2c(c1OC)CN(C)CC2	C12H17NO2	unknown
+COc1cc2cc[n+]([O-])c(C)c2cc1OC	C12H13NO3	unknown
+COc1cc2c(cc1O)CCN(C)C2C	C12H17NO2	unknown
+COc1ccc2c(c1O)C(C)NCC2	C11H15NO2	unknown
+COc1cc2c(cc1O)C(C)=[N+](C)CC2	C12H15NO2	unknown
+COc1cc2c(cc1O)C(CO)N(C)CC2	C12H17NO3	unknown
+COc1cc2c(cc1OC)C(C(C)NC(=O)CNC(=O)C(N)C(C)C)N(C)CC2	C21H34N4O4	unknown
+COc1cc2c(cc1Oc1c(O)c(OC)cc3c1C(CC(C)C)N(C)CC3)C(CC(C)C)N(C)CC2	C30H44N2O4	unknown
+COc1cc2c(c(O)c1O)CNCC2	C10H13NO3	unknown
+Cc1ccc(S(=O)(=O)N(C)C(C)Cc2ccccc2)cc1	C17H21NO2S	unknown
+CN(C(=O)OC(C)(C)C)C1(c2ccccc2Cl)CCCCC1=O	C18H24ClNO3	unknown
+CC(Cc1ccc2c(c1)OCO2)NC(=O)[C@@H](N)CCCCN	C16H25N3O3	unknown
+CC(Cc1ccc2c(c1)OCO2)N(C)C(=O)[C@@H](N)CCCCN	C17H27N3O3	unknown
+Cc1nnc(C)n1C1=NCC(=O)Nc2ccc(Cl)cc21	C13H12ClN5O	aryldiazepine,prophetic
+Cc1nnc(C2CC2)n1C1=NCC(=O)Nc2ccc(Cl)cc21	C15H14ClN5O	aryldiazepine,prophetic
+Cc1nnc(CN)n1C1=NCC(=O)Nc2ccc(Cl)cc21	C13H13ClN6O	aryldiazepine,prophetic
+C=C(C)Cc1nnc(C)n1C1=NCC(=O)Nc2ccc(Cl)cc21	C16H16ClN5O	aryldiazepine,prophetic
+CCNCCCCc1nnc(C)n1C1=NCC(=O)Nc2ccc(Cl)cc21	C18H23ClN6O	aryldiazepine,prophetic
+CCOCCCCc1nnc(C)n1C1=NCC(=O)Nc2ccc(Cl)cc21	C18H22ClN5O2	aryldiazepine,prophetic
+COCCCNc1nnc(C)n1C1=NCC(=O)Nc2ccc(Cl)cc21	C16H19ClN6O2	aryldiazepine,prophetic
+C=CCOCc1nnc(C)n1C1=NCC(=O)Nc2ccc(Cl)cc21	C16H16ClN5O2	aryldiazepine,prophetic
+O=C1Nc2ccc(Cl)cc2N(c2ccccc2)c2ncncc21	C17H11ClN4O	aryldiazepine,prophetic
+O=C1CN=C(c2ccccc2)c2cc(Cl)ncc2N1	C14H10ClN3O	aryldiazepine,prophetic
+CN(C)CCc1c[nH]c2cccc(OC(=O)CCC(=O)O)c12	C16H20N2O4	tryptamine
+CC(C)N(CCc1c[nH]c2cccc(OC(=O)CCC(=O)O)c12)C(C)C	C20H28N2O4	tryptamine
+CC(C)N(CCc1c[nH]c2cccc(OC(=O)/C=C/C(=O)O)c12)C(C)C	C20H26N2O4	tryptamine
+CN(C)CCn1ccc2ccc(OC(=O)CCC(=O)O)cc21	C16H20N2O4	tryptamine
+CN(C)CCc1c[nH]c2cccc(OC(=O)CCCC(=O)O)c12	C17H22N2O4	tryptamine
+CC(C)N(C)CCc1c[nH]c2cccc(OC(=O)CCCC(=O)O)c12	C19H26N2O4	tryptamine
+CCN(CC)CCc1c[nH]c2cccc(OC(=O)CCCC(=O)O)c12	C19H26N2O4	tryptamine
+CCN(CC)CCc1c[nH]c2cccc(OC(=O)CCC(=O)O)c12	C18H24N2O4	tryptamine
+CC(C)N(CCc1c[nH]c2cccc(OC(=O)CC(C)(C)CC(=O)O)c12)C(C)C	C23H34N2O4	tryptamine
+COc1cc(C2CC2N)c(OC)cc1Cl	C11H14ClNO2	unknown
+CC1NCCOC1c1cccc(I)c1	C11H14INO	unknown
+CN1C(=O)CC[C@H]1c1cccnc1	C10H12N2O	unknown
+Oc1cccc(CC(c2ccccc2)N2CCN(C3CCCCC3)CC2)c1	C24H32N2O	unknown
+CN1CCN(C(Cc2cccc(O)c2)c2ccccc2)CC1	C19H24N2O	unknown
+CCN1CCN(C(Cc2cccc(O)c2)c2ccccc2)CC1	C20H26N2O	unknown
+CCCN1CCN(C(Cc2cccc(O)c2)c2ccccc2)CC1	C21H28N2O	unknown
+CCCCCN1CCN(C(Cc2cccc(O)c2)c2ccccc2)CC1	C23H32N2O	unknown
+Oc1cccc(CC(c2ccccc2)N2CCN(Cc3ccccc3)CC2)c1	C25H28N2O	unknown
+Oc1cccc(CC(c2ccccc2)N2CCN(CCc3ccccc3)CC2)c1	C26H30N2O	unknown
+Oc1cccc(CC(c2ccccc2)N2CCN(c3ccccc3)CC2)c1	C24H26N2O	unknown
+COc1cccc(N2CCN(C(Cc3cccc(O)c3)c3ccccc3)CC2)c1	C25H28N2O2	unknown
+COc1ccc(N2CCN(C(Cc3cccc(O)c3)c3ccccc3)CC2)cc1	C25H28N2O2	unknown
+Oc1cccc(CC(c2ccccc2)N2CCN(c3ccccc3O)CC2)c1	C24H26N2O2	unknown
+Oc1cccc(CC(c2ccccc2)N2CCN(c3ccccc3Cl)CC2)c1	C24H25ClN2O	unknown
+Oc1cccc(CC(c2ccccc2)N2CCN(CC3CC3)CC2)c1	C22H28N2O	unknown
+Oc1cccc(CC(c2ccccc2)N2CCN(CC3CCC3)CC2)c1	C23H30N2O	unknown
+C=CCN1CCN(C(Cc2cccc(O)c2)c2ccccc2)CC1	C21H26N2O	unknown
+Oc1cccc(CC(c2ccccc2)N2CCNCC2)c1	C18H22N2O	unknown
+COc1cccc(CC(N)c2ccccc2)c1	C15H17NO	unknown
+CC(=O)OCC1(N(C(C)=O)c2ccccc2)CCN(CCc2ccccc2)CC1	C24H30N2O3	fentanyl
+CCC(=O)OCC1(N(C(=O)CC)c2ccccc2)CCN(CCc2ccccc2)CC1	C26H34N2O3	fentanyl
+O=C(OCC1(N(C(=O)c2ccccc2)c2ccccc2)CCN(CCc2ccccc2)CC1)c1ccccc1	C34H34N2O3	fentanyl
+CCC(=O)N(c1ccccc1)C1(COC(C)=O)CCN(CCc2ccccc2)CC1	C25H32N2O3	fentanyl
+CCC(=O)OCC1(N(C(C)=O)c2ccccc2)CCN(CCc2ccccc2)CC1	C25H32N2O3	fentanyl
+CCCC(=O)OCC1(N(C(=O)CCC)c2ccccc2)CCN(CCc2ccccc2)CC1	C28H38N2O3	fentanyl
+CC(C)C(=O)OCC1(N(C(=O)C(C)C)c2ccccc2)CCN(CCc2ccccc2)CC1	C28H38N2O3	fentanyl
+CCOC(=O)OCC1(N(C(=O)CC)c2ccccc2)CCN(CCc2ccccc2)CC1	C26H34N2O4	fentanyl
+CCC(=O)N(c1ccccc1)C1(COC(=O)OC)CCN(CCc2ccccc2)CC1	C25H32N2O4	fentanyl
+CCC(=O)N(c1ccccc1)C1(COC(=O)C(C)(C)C)CCN(CCc2ccccc2)CC1	C28H38N2O3	fentanyl
+COC(C)C(=O)OCC1(N(C(=O)C(C)OC)c2ccccc2)CCN(CCc2ccccc2)CC1	C28H38N2O5	fentanyl
+CC(=O)OCC1(N(C(C)=O)c2ccccc2)CCN(CCc2cccs2)CC1	C22H28N2O3S	fentanyl
+CCC(=O)OCC1(N(C(=O)CC)c2ccccc2)CCN(CCc2cccs2)CC1	C24H32N2O3S	fentanyl
+O=C(OCC1(N(C(=O)c2ccccc2)c2ccccc2)CCN(CCc2cccs2)CC1)c1ccccc1	C32H32N2O3S	fentanyl
+CCC(=O)N(c1ccccc1)C1(COC(C)=O)CCN(CCc2cccs2)CC1	C23H30N2O3S	fentanyl
+CCCC(=O)OCC1(N(C(=O)CCC)c2ccccc2)CCN(CCc2cccs2)CC1	C26H36N2O3S	fentanyl
+CC(C)C(=O)OCC1(N(C(=O)C(C)C)c2ccccc2)CCN(CCc2cccs2)CC1	C26H36N2O3S	fentanyl
+CCC(=O)N(c1ccccc1)C1(COC(=O)C(C)(C)C)CCN(CCc2cccs2)CC1	C26H36N2O3S	fentanyl
+COC(C)C(=O)OCC1(N(C(=O)C(C)OC)c2ccccc2)CCN(CCc2cccs2)CC1	C26H36N2O5S	fentanyl
+CCC(=O)OCC1(N(C(=O)CC)c2ccccc2)CCN(CCn2nnn(CC)c2=O)CC1	C23H34N6O4	fentanyl
+CCC(=O)N(c1ccccc1)C1(COC(C)=O)CCN(CCn2nnn(CC)c2=O)CC1	C22H32N6O4	fentanyl
+CCn1nnn(CCN2CCC(COC(=O)C(C)C)(N(C(=O)C(C)C)c3ccccc3)CC2)c1=O	C25H38N6O4	fentanyl
+CCC(=O)N(c1ccccc1)C1(COC(=O)OC)CCN(CCn2nnn(CC)c2=O)CC1	C22H32N6O5	fentanyl
+CCC(=O)N(c1ccccc1)C1(COC(C)=O)CCN(CCn2ncnn2)CC1	C20H28N6O3	fentanyl
+CCCC(=O)OCC1(N(C(=O)CCC)c2ccccc2)CCN(CCn2ncnn2)CC1	C23H34N6O3	fentanyl
+CC(C)C(=O)OCC1(N(C(=O)C(C)C)c2ccccc2)CCN(CCn2ncnn2)CC1	C23H34N6O3	fentanyl
+CCC(=O)N(c1ccccc1)C1(COC(=O)C(C)(C)C)CCN(CCn2ncnn2)CC1	C23H34N6O3	fentanyl
+CCOC(=O)OCC1(N(C(=O)CC)c2ccccc2)CCN(CCn2ncnn2)CC1	C21H30N6O4	fentanyl
+CCC(=O)N(c1ccccc1)C1(COC(=O)OC)CCN(CCn2ncnn2)CC1	C20H28N6O4	fentanyl
+CCC(=O)N(c1ccccc1)C1(COC(C)=O)CCN(CCN2C(=O)c3ccccc3C2=O)CC1	C27H31N3O5	fentanyl
+CCCC(=O)OCC1(N(C(=O)CCC)c2ccccc2)CCN(CCN2C(=O)c3ccccc3C2=O)CC1	C30H37N3O5	fentanyl
+CCOC(=O)OCC1(N(C(=O)CC)c2ccccc2)CCN(CCN2C(=O)c3ccccc3C2=O)CC1	C28H33N3O6	fentanyl
+CCC(=O)N(c1ccccc1)C1(COC(=O)OC)CCN(CCN2C(=O)c3ccccc3C2=O)CC1	C27H31N3O6	fentanyl
+COC(C)C(=O)OCC1(N(C(=O)C(C)OC)c2ccccc2)CCN(CCN2C(=O)c3ccccc3C2=O)CC1	C30H37N3O7	fentanyl
+CCOC(=O)NC1C2CCC(C2)C1c1c[nH]c2ccccc12	C18H22N2O2	tryptamine
+CCOC(=O)NC1C2CCC(C2)C1c1c[nH]c2ccc(OC)cc12	C19H24N2O3	tryptamine
+CCCC(C(=O)c1ccc(CC)s1)N1CCN(C)CC1	C16H26N2OS	unknown
+C/C(=C\c1ccccc1C)[N+](=O)[O-]	C10H11NO2	unknown
+C/C(=C\c1cccc(C)c1)[N+](=O)[O-]	C10H11NO2	unknown
+C/C(=C\c1ccc(C)cc1)[N+](=O)[O-]	C10H11NO2	unknown
+C/C(=C\c1cccc(C)c1C)[N+](=O)[O-]	C11H13NO2	unknown
+C/C(=C\c1ccc(C)cc1C)[N+](=O)[O-]	C11H13NO2	unknown
+C/C(=C\c1c(C)cccc1C)[N+](=O)[O-]	C11H13NO2	unknown
+C/C(=C\c1ccc(C)c(C)c1)[N+](=O)[O-]	C11H13NO2	unknown
+C/C(=C\c1cc(C)cc(C)c1)[N+](=O)[O-]	C11H13NO2	unknown
+C/C(=C\c1c(C)cc(C)cc1C)[N+](=O)[O-]	C12H15NO2	unknown
+O=Cc1c[nH]c2ccc3c(c12)CCCO3	C12H11NO2	unknown
+O=[N+]([O-])/C=C/c1c[nH]c2ccc3c(c12)CCCO3	C13H12N2O3	unknown
+Cn1cc(C=O)c2c3c(ccc21)OCCC3	C13H13NO2	unknown
+Cn1cc(/C=C/[N+](=O)[O-])c2c3c(ccc21)OCCC3	C14H14N2O3	unknown
+O=Cc1ccc2c(c1)CCO2	C9H8O2	unknown
+O=Cc1ccc2c(c1)CCCC2	C11H12O	unknown
+C/C(=C\c1ccc2c(c1)CCO2)[N+](=O)[O-]	C11H11NO3	unknown
+C/C(=C\c1ccc2c(c1)CCCC2)[N+](=O)[O-]	C13H15NO2	unknown
+COc1ccc2c(c1/C=C(\C)[N+](=O)[O-])CCO2	C12H13NO4	unknown
+COc1cc(/C=C(\C)[N+](=O)[O-])ccc1C	C11H13NO3	unknown
+COc1cc(OC)c(C=O)cc1F	C9H9FO3	unknown
+COc1cc(F)c(/C=C(\C)[N+](=O)[O-])cc1OC	C11H12FNO4	unknown
+COc1cc(OC)c(/C=C(\C)[N+](=O)[O-])cc1F	C11H12FNO4	unknown
+CN(CCc1ccccc1)Cc1ccc(N=[N+]=[N-])cc1	C16H18N4	unknown
+CN(CCc1ccc(N=[N+]=[N-])cc1)Cc1ccccc1	C16H18N4	unknown
+CN(CCc1ccc(N=[N+]=[N-])cc1)Cc1ccc(N=[N+]=[N-])cc1	C16H17N7	unknown
+CCCCCCCOc1ccc2[nH]cc(CCN)c2c1	C17H26N2O	tryptamine
+CCCCCCCCOc1ccc2[nH]cc(CCN)c2c1	C18H28N2O	tryptamine
+CCCCCCCCCCOc1ccc2[nH]cc(CCN)c2c1	C20H32N2O	tryptamine
+CCCCCCCCCCCOc1ccc2[nH]cc(CCN)c2c1	C21H34N2O	tryptamine
+CC(C)CCCCCCOc1ccc2[nH]cc(CCN)c2c1	C19H30N2O	tryptamine
+CC(C)(C)CCCCCCOc1ccc2[nH]cc(CCN)c2c1	C20H32N2O	tryptamine
+NCCc1c[nH]c2ccc(OCCCCC3CCCCC3)cc12	C20H30N2O	tryptamine
+CCCCCCCCCOc1ccc2[nH]cc(CCN(C)C)c2c1	C21H34N2O	tryptamine
+CCCCCCCCCOc1ccc2[nH]cc(CCNCCCC)c2c1	C23H38N2O	tryptamine
+CCCCCCCCCOc1ccc2[nH]cc(CC(C)N)c2c1	C20H32N2O	tryptamine
+CCCCCCCCCCc1ccc2[nH]cc(CCN)c2c1	C20H32N2	tryptamine
+CCC(=O)Oc1ccc2[nH]cc(CCN(C)C)c2c1	C15H20N2O2	tryptamine
+CC(C)C(=O)Oc1ccc2[nH]cc(CCN(C)C)c2c1	C16H22N2O2	tryptamine
+CN(C)CCc1c[nH]c2ccc(OC(=O)C(C)(C)C)cc12	C17H24N2O2	tryptamine
+CCCCCCCCC(=O)Oc1ccc2[nH]cc(CCN(C)C)c2c1	C21H32N2O2	tryptamine
+COc1ccc2[nH]c3c(c2c1)CC(N)CC3	C13H16N2O	unknown
+COc1ccc2[nH]c3c(c2c1)CC(N(C)C)CC3	C15H20N2O	unknown
+NC(=O)c1ccc2[nH]c3c(c2c1)CC(N)CC3	C13H15N3O	unknown
+CCCCCCCCCOc1ccc2[nH]c3c(c2c1)CC(N)CC3	C21H32N2O	unknown
+CCCCCCOc1ccc2[nH]c3c(c2c1)CC(N)CC3	C18H26N2O	unknown
+CCCCCCCCCCc1ccc2[nH]c3c(c2c1)CC(N)CC3	C22H34N2	unknown
+CCCCCCCCCOc1ccc2[nH]c3c(c2c1)CCN(C)C3	C21H32N2O	unknown
+CCN(CC)CCn1c(Cc2ccc(OC)cc2)nc2ccc([N+](=O)[O-])cc21	C21H26N4O3	unknown
+CCCOc1ccc(Cc2nc3ccc([N+](=O)[O-])cc3n2CCN(CC)CC)cc1	C23H30N4O3	unknown
+CCN(CC)CCn1c(Cc2ccc(OC(C)C)cc2)nc2ccc([N+](=O)[O-])cc21	C23H30N4O3	unknown
+CC(C)NC(=O)C(=O)c1c[nH]c2cccc(OCc3ccccc3)c12	C20H20N2O3	unknown
+CC(C)NCCc1c[nH]c2cccc(OCc3ccccc3)c12	C20H24N2O	tryptamine
+COc1cc(C[C@@H]2CCC[C@@H](c3ccccc3O)N2)c(OC)cc1C#N	C21H24N2O3	unknown
+COc1cc(C[C@H]2CCC[C@H](c3ccccc3O)N2)c(OC)cc1C#N	C21H24N2O3	unknown
+COc1cc(C[C@H]2CCC[C@@H](c3ccccc3O)N2)c(OC)cc1C#N	C21H24N2O3	unknown
+COc1cc(C[C@@H]2CCC[C@H](c3ccccc3O)N2)c(OC)cc1C#N	C21H24N2O3	unknown
+COc1cc(CCN(C=O)C=O)cc(OC)c1OC	C13H17NO5	unknown
+CCCCCC(NCc1ccccc1)C(=O)c1ccccc1	C20H25NO	beta-ketone
+COc1ccc(CC(C)N2CCCC2)cc1OC	C15H23NO2	unknown
+CC(C)[C@H](NC(=O)c1nn(CCc2ccccc2)c2ccccc12)C(N)=O	C21H24N4O2	cannabinoid
+COc1cc(CCNC2COc3ccccc32)c(OC)cc1Br	C18H20BrNO3	unknown
+COc1cc(CCNC2CCOc3ccccc32)c(OC)cc1Br	C19H22BrNO3	unknown
+COc1cc(CCNCc2cccc(O)c2)c(OC)cc1C#N	C18H20N2O3	unknown
+COc1cc(CCNC2COc3ccccc32)c(OC)cc1C#N	C19H20N2O3	unknown
+CC(=O)NCCc1c[nH]c2cc(F)cc(N)c12	C12H14FN3O	tryptamine
+CC(=O)NCCc1c[nH]c2cc(NC(C)=O)cc(F)c12	C14H16FN3O2	tryptamine
+CC(=O)NCCc1c[nH]c2c([N+](=O)[O-])cc(F)cc12	C12H12FN3O3	tryptamine
+CC(=O)NCCc1c[nH]c2cc(NC(C)=O)c(F)cc12	C14H16FN3O2	tryptamine
+CC(=O)NCCc1c[nH]c2cc(N)c(F)cc12	C12H14FN3O	tryptamine
+CC(=O)NCCc1c[nH]c2ccc(C#N)c(F)c12	C13H12FN3O	tryptamine
+CC(=O)NCCc1c[nH]c2cc(Br)cc(O)c12	C12H13BrN2O2	tryptamine
+CC(=O)NCCc1c[nH]c2c(C#N)ccc(F)c12	C13H12FN3O	tryptamine
+CC(=O)NCCc1c[nH]c2cc(N)cc(F)c12	C12H14FN3O	tryptamine
+CC(=O)NCCc1c[nH]c2cc(C#N)cc(N)c12	C13H14N4O	tryptamine
+CC(=O)NCCc1c[nH]c2ccc(O)c(F)c12	C12H13FN2O2	tryptamine
+NCCc1c[nH]c2c([N+](=O)[O-])cc(F)cc12	C10H10FN3O2	tryptamine
+NCCc1c[nH]c2cc(N)c(F)cc12	C10H12FN3	tryptamine
+N#Cc1ccc2[nH]cc(CCN)c2c1F	C11H10FN3	tryptamine
+NCCc1c[nH]c2cc(F)cc(N)c12	C10H12FN3	tryptamine
+NCCc1c[nH]c2cc(N)cc(F)c12	C10H12FN3	tryptamine
+N#Cc1cc(N)c2c(CCN)c[nH]c2c1	C11H12N4	tryptamine
+CNCCc1c[nH]c2cc(C#N)cc(N)c12	C12H14N4	tryptamine
+CC(=O)NCCc1c[nH]c2c(CC=C(C)C)ccc(Cl)c12	C17H21ClN2O	tryptamine
+CC(=O)NCCc1c[nH]c2c(CC=C(C)C)cc(F)cc12	C17H21FN2O	tryptamine
+CC(C)=CCc1cc(F)cc2c(CCN)c[nH]c12	C15H19FN2	tryptamine
+CC(C)=C(C)Cc1ccc(O)c2c(CC(N)C(=O)O)c[nH]c12	C17H22N2O3	tryptamine
+CC(C)=CCc1cc(O)c2c(CC(N)C(=O)O)c[nH]c2c1	C16H20N2O3	tryptamine
+CC(C)=CCc1cc2[nH]cc(CC(N)C(=O)O)c2cc1Br	C16H19BrN2O2	tryptamine
+CC(C)=CCc1ccc2[nH]cc(CC(N)C(=O)O)c2c1O	C16H20N2O3	tryptamine
+CC(=O)NCCc1c[nH]c2cc(CC=C(C)C)c(Cl)cc12	C17H21ClN2O	tryptamine
+CC(=O)NCCc1c[nH]c2cc(CC=C(C)C)c(F)cc12	C17H21FN2O	tryptamine
+CC(C)=CCc1cc2[nH]cc(CCN)c2cc1F	C15H19FN2	tryptamine
+CC(C)=CCc1cc2[nH]cc(CCN)c2cc1Cl	C15H19ClN2	tryptamine
+CN(C)CCc1c[nH]c2cc(Cl)cc(O)c12	C12H15ClN2O	tryptamine
+CN(C)CCc1c[nH]c2c(Cl)ccc(O)c12	C12H15ClN2O	tryptamine
+NCCc1c[nH]c2cc(F)cc(O)c12	C10H11FN2O	tryptamine
+CN(C)CCc1c[nH]c2cc(Br)cc(O)c12	C12H15BrN2O	tryptamine
+NCCc1c[nH]c2cc(Br)cc(O)c12	C10H11BrN2O	tryptamine
+CC(C)=CCc1c(Br)ccc2[nH]cc(CC(N)C(=O)O)c12	C16H19BrN2O2	tryptamine
+CC(C)=CCc1cc(F)cc2[nH]cc(CC(N)C(=O)O)c12	C16H19FN2O2	tryptamine
+CCC(=O)Oc1cc(CC=C(C)C)cc2[nH]cc(CCN(C)C)c12	C20H28N2O2	tryptamine
+CC(=O)Oc1cc(CC=C(C)C)cc2[nH]cc(CCN(C)C)c12	C19H26N2O2	tryptamine
+CCN(CC)CCc1c[nH]c2cc(CC=C(C)C)cc(OC(C)=O)c12	C21H30N2O2	tryptamine
+CC(C)=CCc1cc2[nH]cc(CCN(C)C)c2cc1Cl	C17H23ClN2	tryptamine
+CC(C)=CCc1cc(O)c2c(CN(C)C(C)C)c[nH]c2c1	C18H26N2O	unknown
+CC(C)=CCc1cc2[nH]cc(CCN)c2cc1Br	C15H19BrN2	tryptamine
+NCCc1c[nH]c2c(Br)cc(O)c(F)c12	C10H10BrFN2O	tryptamine
+Cc1ccc2[nH]cc(CCN(C)C)c2c1OP(=O)(O)O	C13H19N2O4P	tryptamine
+COCCc1cc(OC)c(C=O)cc1OC	C12H16O4	unknown
+COCCc1cc(OC)c(/C=C(\C)[N+](=O)[O-])cc1OC	C14H19NO5	unknown
+CO[C@]12CC[C@@]3(C[C@@H]1C(C)(C)O)[C@H]1Cc4ccc(O)c5c4[C@@]3(CCN1CC1CC1)[C@H]2O5	C26H35NO4	unknown
+CC[C@H]1[C@@H]2Cc3ccc(O)cc3[C@@]1(CC)CCN2C	C17H25NO	unknown
+C[C@H]1[C@H]2C(=O)c3ccc(O)cc3[C@]1(C)CCN2CC1CC1	C18H23NO2	unknown
+CCCN1CC[C@@]2(C)c3cc(O)ccc3C[C@@H]1[C@@H]2C	C17H25NO	unknown
+C[C@H]1[C@H]2Cc3ccc(O)cc3[C@]1(C)CCN2c1ccccc1	C20H23NO	unknown
+CCOC(=O)C1(c2ccccc2)CCN(CC)CC1	C16H23NO2	unknown
+CCCCN1CCC(C(=O)OCC)(c2ccccc2)CC1	C18H27NO2	unknown
+CCCCCCCCCN1CCC(C(=O)OCC)(c2ccccc2)CC1	C23H37NO2	unknown
+CCC(=O)C1(c2cccc(O)c2)CCN(CC)CC1	C16H23NO2	unknown
+CCCN1CCC(C(=O)CC)(c2cccc(O)c2)CC1	C17H25NO2	unknown
+CCCCN1CCC(C(=O)CC)(c2cccc(O)c2)CC1	C18H27NO2	unknown
+CCCCCCN1CCC(C(=O)CC)(c2cccc(O)c2)CC1	C20H31NO2	unknown
+CCCCCCCN1CCC(C(=O)CC)(c2cccc(O)c2)CC1	C21H33NO2	unknown
+CCCCCCCCN1CCC(C(=O)CC)(c2cccc(O)c2)CC1	C22H35NO2	unknown
+CCCCCCCCCN1CCC(C(=O)CC)(c2cccc(O)c2)CC1	C23H37NO2	unknown
+CCCCCCCCCCN1CCC(C(=O)CC)(c2cccc(O)c2)CC1	C24H39NO2	unknown
+COc1ccc(N2CCCCC2)cc1	C12H17NO	unknown
+COc1cccc(N2CCCCC2)c1	C12H17NO	unknown
+COc1ccccc1N1CCCCC1	C12H17NO	unknown
+c1ccc(N2CCOCC2)cc1	C10H13NO	unknown
+OCc1cccc(N2CCCCC2)c1	C12H17NO	unknown
+OCc1ccccc1N1CCCCC1	C12H17NO	unknown
+COc1cc(Br)c2[nH]ccc2c1CC(C)N	C12H15BrN2O	unknown
+COc1cc(Br)c2c(c1CC(C)N)CCS2	C12H16BrNOS	unknown
+COc1cc(CC(C)N)c2occc2c1C	C13H17NO2	unknown
+COc1cc(CC(C)N)c2c(c1C)CCO2	C13H19NO2	unknown
+COc1cc(CCN)c2ccoc2c1OC	C12H15NO3	unknown
+COc1c2occc2c(CCN)c2ccoc12	C13H13NO3	unknown
+COc1ccccc1CC(C)=O	C10H12O2	unknown
+NCC1Cc2ccccc2-c2ccccc21	C15H15N	unknown
+CC(Nc1ccccc1)C(=O)c1ccccc1	C15H15NO	beta-ketone
+N#Cc1ccc(C(c2ccc(C#N)cc2)n2cncn2)cc1	C17H11N5	unknown
+CC1=CC[C@@H]2[C@@H](C1)c1c(O)cc(Cc3ccccc3)cc1OC2(C)C	C23H26O2	cannabinoid
+CC1=CC[C@@H]2[C@@H](C1)c1c(O)cc(C(=O)c3ccccc3)cc1OC2(C)C	C23H24O3	cannabinoid
+COc1ccc([C@@H]2Sc3ccccc3N(CCN(C)C)C(=O)[C@@H]2OC(C)=O)cc1	C22H26N2O4S	unknown
+Fc1ccc(OC(CN2CCN(c3cccc(Cl)c3)CC2)c2ccccc2)cc1	C24H24ClFN2O	unknown
+COc1ccccc1N1CCN(CC(Oc2ccc(F)cc2)c2ccccc2)CC1	C25H27FN2O2	unknown
+Fc1ccc(OC(CN2CCN(c3cccc(C(F)(F)F)c3)CC2)c2ccccc2)cc1	C25H24F4N2O	unknown
+COc1ccc2[nH]cc(CCN(C)CC3CC3)c2c1	C16H22N2O	tryptamine
+CN(CCc1c[nH]c2ccccc12)CC1CCCO1	C16H22N2O	tryptamine
+COc1ccc2[nH]cc(CCN(C)CC3CCCO3)c2c1	C17H24N2O2	tryptamine
+CC(C)=CCN(C)CCc1c[nH]c2ccccc12	C16H22N2	tryptamine
+COc1ccc2[nH]cc(CCN(C)CC=C(C)C)c2c1	C17H24N2O	tryptamine
+CN(CC#N)CCc1c[nH]c2ccccc12	C13H15N3	tryptamine
+COc1ccc2[nH]cc(CCN(C)CCc3cccc(OC(C)=O)c3)c2c1	C22H26N2O3	tryptamine
+COc1cccc(CCN(C)CCc2c[nH]c3ccc(OC)cc23)c1	C21H26N2O2	tryptamine
+CN(CCc1c[nH]c2ccccc12)CC[N+](=O)[O-]	C13H17N3O2	tryptamine
+COc1ccc2[nH]cc(CCN(C)CC[N+](=O)[O-])c2c1	C14H19N3O3	tryptamine
+COc1ccc2[nH]cc(CCN(C)CCc3ccc(Cl)cc3)c2c1	C20H23ClN2O	tryptamine
+CN(CCc1ccccc1Br)CCc1c[nH]c2ccccc12	C19H21BrN2	tryptamine
+COc1ccc2[nH]cc(CCN(C)CCc3ccccc3Br)c2c1	C20H23BrN2O	tryptamine
+COc1ccc2[nH]cc(CCN(C)CCc3c(OC)cccc3OC)c2c1	C22H28N2O3	tryptamine
+CN(CCc1c[nH]c2ccccc12)CC(c1ccccc1)c1ccccc1	C25H26N2	tryptamine
+COc1ccc2[nH]cc(CCN(C)CC(c3ccccc3)c3ccccc3)c2c1	C26H28N2O	tryptamine
+COc1ccc2[nH]cc(CCN(C)CCO)c2c1	C14H20N2O2	tryptamine
+CN(CCOCCO)CCc1c[nH]c2ccccc12	C15H22N2O2	tryptamine
+COc1ccc2[nH]cc(CCN(C)CCOCCO)c2c1	C16H24N2O3	tryptamine
+CN(CCCl)CCc1c[nH]c2ccccc12	C13H17ClN2	tryptamine
+COc1ccc2[nH]cc(CCN(C)CCCl)c2c1	C14H19ClN2O	tryptamine
+CN(CCc1c[nH]c2ccccc12)CC(C)(C)C	C16H24N2	tryptamine
+COc1ccc2[nH]cc(CCN(C)CC(C)(C)C)c2c1	C17H26N2O	tryptamine
+COc1ccc(OC)c(CCCN(C)CCc2c[nH]c3ccccc23)c1	C22H28N2O2	tryptamine
+CN(CCCCc1c[nH]c2ccccc12)CCc1c[nH]c2ccccc12	C23H27N3	tryptamine
+COc1ccc2[nH]cc(CCN(C)CCCCc3c[nH]c4ccccc34)c2c1	C24H29N3O	tryptamine
+CN(CCCCl)CCc1c[nH]c2ccccc12	C14H19ClN2	tryptamine
+COc1ccc2[nH]cc(CCN(C)CCCCl)c2c1	C15H21ClN2O	tryptamine
+CCOC(=O)CCCN(C)CCc1c[nH]c2ccccc12	C17H24N2O2	tryptamine
+CCOC(=O)CCCN(C)CCc1c[nH]c2ccc(OC)cc12	C18H26N2O3	tryptamine
+CCCCCCCN(C)CCc1c[nH]c2ccc(OC)cc12	C19H30N2O	tryptamine
+COc1ccc2[nH]cc(CCNC(=O)c3ccc(Br)cc3)c2c1	C18H17BrN2O2	tryptamine
+COc1ccc(/C=C/[N+](=O)[O-])c(OC)c1C	C11H13NO4	unknown
+CC(N)Cc1cccc2c1CCC2	C12H17N	unknown
+CCCCn1cc(CCN(C)C)c2c(O)cccc21	C16H24N2O	tryptamine
+COc1ccc2[nH]cc(C(=O)C(=O)N(C(C)C)C(C)C)c2c1	C17H22N2O3	tryptamine
+CCCSc1cc(OC)c(/C=C(\CC)[N+](=O)[O-])cc1OC	C15H21NO4S	unknown
+Cc1c(C(=O)c2ccccc2I)c2ccc(N)cc2n1CC1CCCCN1C	C23H26IN3O	cannabinoid
+Cc1c(C(=O)c2ccccc2)c2ccc(N=[N+]=[N-])cc2n1CC1CCCCN1C	C23H25N5O	cannabinoid
+Cc1c(C(=O)c2ccccc2)c2ccc(N=C=S)cc2n1CC1CCCCN1C	C24H25N3OS	cannabinoid
+Cc1c(C(=O)c2ccccc2I)c2ccc(N=[N+]=[N-])cc2n1CC1CCCCN1C	C23H24IN5O	cannabinoid
+Cc1c(C(=O)c2ccccc2I)c2ccc(N=C=S)cc2n1CC1CCCCN1C	C24H24IN3OS	cannabinoid
+CN1CCCCC1Cn1cc(C(=O)c2cc(N=[N+]=[N-])ccc2I)c2ccc(N=[N+]=[N-])cc21	C22H21IN8O	cannabinoid
+Cc1c(C(=O)c2cccc3ccccc23)c2ccc(N)cc2n1CC1CCCCN1C	C27H29N3O	cannabinoid
+Cc1c(C(=O)c2cccc3ccccc23)c2ccc(N=[N+]=[N-])cc2n1CC1CCCCN1C	C27H27N5O	cannabinoid
+CN1CCCCC1Cn1cc(C(=O)c2cccc3ccccc23)c2ccc(N)cc21	C26H27N3O	cannabinoid
+CN1CCCCC1Cn1cc(C(=O)c2cccc3ccccc23)c2ccc(N=[N+]=[N-])cc21	C26H25N5O	cannabinoid
+CN1CCCCC1Cn1cc(C(=O)c2cccc3ccccc23)c2ccc(N=C=S)cc21	C27H25N3OS	cannabinoid
+CN1CCCCC1Cn1cc(C(=O)c2ccc(I)c3ccccc23)c2ccc(N=[N+]=[N-])cc21	C26H24IN5O	cannabinoid
+CCCCCCCn1c(C)c(C(=O)c2ccccc2I)c2ccccc21	C23H26INO	unknown
+CC(=O)OCCCCCn1c(C)c(C(=O)c2ccccc2I)c2ccccc21	C23H24INO3	cannabinoid
+Cc1c(C(=O)c2ccccc2I)c2ccccc2n1CCCCCO	C21H22INO2	cannabinoid
+Cc1ccc(S(=O)(=O)OCCCCCn2c(C)c(C(=O)c3ccccc3I)c3ccccc32)cc1	C28H28INO4S	cannabinoid
+Cc1c(C(=O)c2ccccc2I)c2ccccc2n1CCCCCI	C21H21I2NO	cannabinoid
+Cc1c(C(=O)c2ccccc2I)c2ccccc2n1CCCCCN=C=S	C22H21IN2OS	cannabinoid
+CC(=O)OCCCCCn1cc(C(=O)c2ccccc2I)c2ccccc21	C22H22INO3	cannabinoid
+O=C(c1c(I)cccc1I)c1cn(CCCCCO)c2ccccc12	C20H19I2NO2	cannabinoid
+Cc1ccc(S(=O)(=O)OCCCCCn2cc(C(=O)c3ccccc3I)c3ccccc32)cc1	C27H26INO4S	cannabinoid
+O=C(c1ccccc1I)c1cn(CCCCCI)c2ccccc12	C20H19I2NO	cannabinoid
+O=C(c1ccccc1I)c1cn(CCCCCN=C=S)c2ccccc12	C21H19IN2OS	cannabinoid
+CCCCCn1cc(C(=O)c2cc([N+](=O)[O-])ccc2I)c2ccccc21	C20H19IN2O3	cannabinoid
+CCCCCn1cc(C(=O)c2cc(N)ccc2I)c2ccccc21	C20H21IN2O	cannabinoid
+CCCCCn1cc(C(=O)c2cc(N=C=S)ccc2I)c2ccccc21	C21H19IN2OS	cannabinoid
+CCCCCn1cc(C(=O)c2cc(N=[N+]=[N-])ccc2I)c2ccccc21	C20H19IN4O	cannabinoid
+CCCCCn1cc(C(=O)c2cc(I)ccc2I)c2ccccc21	C20H19I2NO	cannabinoid
+CC(=O)OCCCn1cc(C(=O)c2cccc3ccccc23)c2ccccc21	C24H21NO3	cannabinoid
+Cc1ccc(S(=O)(=O)OCCCn2cc(C(=O)c3cccc4ccccc34)c3ccccc32)cc1	C29H25NO4S	cannabinoid
+O=C(c1cccc2ccccc12)c1cn(CCCN=C=S)c2ccccc12	C23H18N2OS	cannabinoid
+CC(=O)OCCCCn1cc(C(=O)c2cccc3ccccc23)c2ccccc21	C25H23NO3	cannabinoid
+O=C(c1cccc2ccccc12)c1cn(CCCCO)c2ccccc12	C23H21NO2	cannabinoid
+Cc1ccc(S(=O)(=O)OCCCCn2cc(C(=O)c3cccc4ccccc34)c3ccccc32)cc1	C30H27NO4S	cannabinoid
+O=C(c1cccc2ccccc12)c1cn(CCCCN=C=S)c2ccccc12	C24H20N2OS	cannabinoid
+O=C(c1cccc2ccccc12)c1cn(CCCCCN=C=S)c2ccccc12	C25H22N2OS	cannabinoid
+CC(=O)OCCCCCn1cc(C(=O)c2cccc3ccccc23)c2ccc([N+](=O)[O-])cc21	C26H24N2O5	cannabinoid
+O=C(c1cccc2ccccc12)c1cn(CCCCCO)c2cc([N+](=O)[O-])ccc12	C24H22N2O4	cannabinoid
+CC(=O)OCCCCCn1cc(C(=O)c2cccc3ccccc23)c2ccc(N)cc21	C26H26N2O3	cannabinoid
+Nc1ccc2c(C(=O)c3cccc4ccccc34)cn(CCCCCO)c2c1	C24H24N2O2	cannabinoid
+O=C(c1cccc2ccccc12)c1cn(CCCCCO)c2cc(I)ccc12	C24H22INO2	cannabinoid
+[N-]=[N+]=Nc1ccc(C(=O)c2cn(CCCCI)c3ccccc23)c2ccccc12	C23H19IN4O	cannabinoid
+O=C(c1ccc(N=C=S)c2ccccc12)c1cn(CCCCI)c2ccccc12	C24H19IN2OS	cannabinoid
+C[C@]12C=CC(=O)C(Cl)=C1CC[C@@H]1[C@@H]2CC[C@@]2(C)[C@H]1CC[C@]2(C)O	C20H27ClO2	unknown
+C[C@]12Cc3c[nH]nc3C[C@@H]1CC[C@@H]1[C@@H]2CC[C@@]2(C)[C@H]1CC[C@]2(C)O	C21H32N2O	unknown
+C[C@]12C=CC(=O)C=C1CC[C@@H]1[C@@H]2CC[C@@]2(C)[C@H]1CC[C@]2(C)O	C20H28O2	unknown
+O=[N+]([O-])/C=C/c1ccc2c(c1)OC(F)(F)O2	C9H5F2NO4	unknown
+C/C(=C\c1ccc2c(c1)OC(F)(F)O2)[N+](=O)[O-]	C10H7F2NO4	unknown
+CC/C(=C\c1ccc2c(c1)OC(F)(F)O2)[N+](=O)[O-]	C11H9F2NO4	unknown
+Cc1ccccc1COc1ccc2[nH]cc(CCN)c2c1	C18H20N2O	tryptamine
+Cc1cccc(COc2ccc3[nH]cc(CCN)c3c2)c1	C18H20N2O	tryptamine
+Cc1ccc(COc2ccc3[nH]cc(CCN)c3c2)cc1	C18H20N2O	tryptamine
+NCCc1c[nH]c2ccc(OCc3ccccc3F)cc12	C17H17FN2O	tryptamine
+NCCc1c[nH]c2ccc(OCc3cccc(F)c3)cc12	C17H17FN2O	tryptamine
+NCCc1c[nH]c2ccc(OCc3ccc(F)cc3)cc12	C17H17FN2O	tryptamine
+NCCc1c[nH]c2ccc(OCc3ccccn3)cc12	C16H17N3O	tryptamine
+NCCc1c[nH]c2ccc(OCc3cccnc3)cc12	C16H17N3O	tryptamine
+NCCc1c[nH]c2ccc(OCc3ccncc3)cc12	C16H17N3O	tryptamine
+NCCc1c[nH]c2ccc(OCc3cccc4ccccc34)cc12	C21H20N2O	tryptamine
+NCCc1c[nH]c2ccc(OCc3ccc4ccccc4c3)cc12	C21H20N2O	tryptamine
+CC(CN)c1c[nH]c2ccc(OCc3cccs3)cc12	C16H18N2OS	tryptamine
+CC(N)C(O)c1c2c(c(Br)c3c1OCC3)OCC2	C13H16BrNO3	unknown
+CCC(=O)Oc1ccc2c3c1O[C@H]1[C@@H](OC(=O)CC)C=C[C@H]4[C@@H](C2)N(C)CC[C@@]341	C23H27NO5	unknown
+Fc1ccc2c(c1Cl)CCNCC2	C10H11ClFN	unknown
+Clc1ccc2c(c1Cl)CCNCC2	C10H11Cl2N	unknown
+CCOC(=O)c1ccc(NC=O)cc1	C10H11NO3	unknown
+CCN(CC)CCOC(=O)c1ccc(NC=O)cc1	C14H20N2O3	unknown
+CCc1cccc2c3c([nH]c12)C(CC)(CC(=O)O)OCC3	C17H21NO3	unknown
+COc1ccc([C@@H]2Sc3ccccc3N(CCN(C)C)C(=O)[C@@H]2O)cc1	C20H24N2O3S	unknown
+COc1ccc(C2=CC(=O)N(CCN(C)C)c3ccccc3S2)cc1	C20H22N2O2S	unknown
+C[N+](C)(CCCl)CCc1c[nH]c2ccccc12	C14H20ClN2	tryptamine
+C[N+](C)(CBr)CCc1c[nH]c2ccccc12	C13H18BrN2	tryptamine
+CCCNCCc1c[nH]c2ccc(OCC)cc12	C15H22N2O	tryptamine
+COc1ccc(OC)c(CC(C)NO)c1	C11H17NO3	unknown
+COc1cc(CC(C)NO)cc(OC)c1OC	C12H19NO4	unknown
+CCC(Cc1ccc(SC)cc1)NC(C)C	C14H23NS	tryptamine
+CCCCCSc1ccc(C(N)CC)cc1	C14H23NS	unknown
+CCC(N)c1ccc(SC)cc1	C10H15NS	unknown
+CSc1ccc(CC(C)NCCS)cc1	C12H19NS2	unknown
+CCONC(C)Cc1ccc(SC)cc1	C12H19NOS	unknown
+C=CCONC(C)Cc1ccc(SC)cc1	C13H19NOS	unknown
+C=CCNC(CC)Cc1ccc(SC)cc1	C14H21NS	unknown
+CCC(Cc1ccc(SC)cc1)NCCO	C13H21NOS	unknown
+CCC(Cc1ccc(SC)cc1)N(C)C	C13H21NS	unknown
+CCC(Cc1ccc(SC)cc1)N(C)O	C12H19NOS	unknown
+CCC(Cc1ccc(SC)cc1)NOC	C12H19NOS	unknown
+CCONC(CC)Cc1ccc(SC)cc1	C13H21NOS	unknown
+C=CCONC(CC)Cc1ccc(SC)cc1	C14H21NOS	unknown
+CCOc1ccccc1CC(C)N(C)C	C13H21NO	unknown
+CCNC(C)Cc1ccccc1OCC	C13H21NO	unknown
+CCOc1cccc(CC(C)N(C)C)c1	C13H21NO	unknown
+CCNC(C)Cc1cccc(OCC)c1	C13H21NO	unknown
+CCOc1ccc(CC(C)N(C)C)cc1	C13H21NO	unknown
+CCNC(C)Cc1ccc(OCC)cc1	C13H21NO	unknown
+COc1ccc(/N=C2\C(=O)N(CCN3CCOCC3)c3ccccc32)cc1	C21H23N3O3	cannabinoid
+COc1ccc(/N=C2\C(=O)N(CCN3CCOCC3)c3ccc(Cl)cc32)cc1	C21H22ClN3O3	cannabinoid
+COc1ccc(/N=C2\C(=O)N(CCN3CCOCC3)c3ccc(C)cc32)cc1	C22H25N3O3	cannabinoid
+O=C1/C(=N\c2cccc3ccccc23)c2ccccc2N1CCN1CCOCC1	C24H23N3O2	cannabinoid
+Cc1ccc2c(c1)/C(=N/c1cccc3ccccc13)C(=O)N2CCN1CCOCC1	C25H25N3O2	cannabinoid
+COc1ccc(NCc2cn(CCN3CCOCC3)c3ccccc23)cc1	C22H27N3O2	cannabinoid
+c1ccc2c(NCc3cn(CCN4CCOCC4)c4ccccc34)cccc2c1	C25H27N3O	cannabinoid
+Clc1ccc(NCc2cn(CCN3CCOCC3)c3ccccc23)cc1	C21H24ClN3O	cannabinoid
+CCOC(=O)c1ccc(NC(C)=O)cc1	C11H13NO3	unknown
+CC1(C)NC(=O)C(Cc2ccc(O)c(O)c2)N1	C12H16N2O3	unknown
+CCC1(CC)NC(=O)C(Cc2ccc(O)c(O)c2)N1	C14H20N2O3	unknown
+N#CCN1CCc2c([nH]c3ccccc23)C1	C13H13N3	unknown
+CNC(Cc1ccc2c(c1)OCO2)Cc1ccc2c(c1)OCO2	C18H19NO4	unknown
+CCCCCn1cc(C(=O)c2ccc(-c3ccccc3)cc2)c2ccccc21	C26H25NO	cannabinoid
+COCCn1cc(C(=O)c2ccc(-c3ccccc3)cc2)c2ccccc21	C24H21NO2	cannabinoid
+COCCn1cc(C(=O)c2cccc(-c3ccccc3)c2)c2ccccc21	C24H21NO2	cannabinoid
+COCCn1cc(C(=O)c2ccccc2-c2ccccc2)c2ccccc21	C24H21NO2	cannabinoid
+CCCCCn1cc(C(=O)Nc2ccc3ccccc3c2)c2ccccc21	C24H24N2O	cannabinoid
+COCCn1cc(C(=O)Nc2cccc3ccccc23)c2ccccc21	C22H20N2O2	cannabinoid
+COCCn1cc(C(=O)Nc2ccc3ccccc3c2)c2ccccc21	C22H20N2O2	cannabinoid
+COCCn1cc(C(=O)c2cccc3ccccc23)c2cccnc21	C21H18N2O2	cannabinoid
+COCCn1cc(C(=O)c2cccc3ccccc23)c2ccncc21	C21H18N2O2	cannabinoid
+CC(C)(C#N)c1cc(Cn2cncn2)cc(C(C)(C)C#N)c1	C17H19N5	unknown
+CCC(C)NCCc1c[nH]c2ccc(OC)cc12	C15H22N2O	tryptamine
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)c3cccs3)C[C@H]2N(C)C1	C25H27N3O2S	unknown
+NC(Cc1ccc(Cl)cc1)Cc1ccc(Cl)cc1	C15H15Cl2N	unknown
+CCCCOc1ccc(C2(N3CCCCC3)CCCCC2)cc1	C21H33NO	arylcycloalkylamine
+CCCCOc1cccc(C2(N3CCCCC3)CCCCC2)c1	C21H33NO	arylcycloalkylamine
+FC(F)(F)COc1cccc(C2(N3CCCCC3)CCCCC2)c1	C19H26F3NO	arylcycloalkylamine
+O=C1NCCC1(c1ccccc1)N1CCCCC1	C15H20N2O	arylcycloalkylamine
+CN1CCC(c2ccccc2)(N2CCCCC2)C1=O	C16H22N2O	arylcycloalkylamine
+O=C1NCCCC1(c1ccccc1)N1CCCCC1	C16H22N2O	arylcycloalkylamine
+CN1CCCC(c2ccccc2)(N2CCCCC2)C1=O	C17H24N2O	arylcycloalkylamine
+CNC1(c2ccccc2Cl)CCCNC1=O	C12H15ClN2O	arylcycloalkylamine
+CNC1(c2ccccc2Cl)CCCN(C)C1=O	C13H17ClN2O	arylcycloalkylamine
+CNC1(c2ccc(OC)cc2Cl)CCCCC1=O	C14H18ClNO2	arylcycloalkylamine
+NCCc1csc2ccc(O)cc12	C10H11NOS	unknown
+CCCC(=O)Oc1ccc2[nH]cc(CCN(C)C)c2c1	C16H22N2O2	tryptamine
+CC1CCCC(C)N1CCc1c[nH]c2ccc(O)cc12	C17H24N2O	tryptamine
+NCCC1CNc2ccccc21	C10H14N2	unknown
+NCCC1CCc2ccccc21	C11H15N	unknown
+NCCc1c[nH]c2ccc(C(=O)Cc3ccccc3)cc12	C18H18N2O	tryptamine
+CN(C)CCc1c[nH]c2ccncc12	C11H15N3	unknown
+COc1ccc2c(c1)c(CCN(C)C)cn2Cc1ccccc1	C20H24N2O	tryptamine
+NCCc1cccc2ccccc12	C12H13N	unknown
+NCCc1cccc2[nH]ccc12	C10H12N2	unknown
+COc1ccc2ccccc2c1N1CCNCC1	C15H18N2O	unknown
+CN1CCC(c2c[nH]c3ccc(O)cc23)CC1	C14H18N2O	unknown
+COc1cccc(CCNCc2ccccc2Cl)c1OC	C17H20ClNO2	unknown
+COc1ccc(CCNCc2ccccc2Cl)c(OC)c1	C17H20ClNO2	unknown
+COc1ccc(OC)c(CCNCc2ccccc2Cl)c1	C17H20ClNO2	unknown
+COc1cccc(OC)c1CCNCc1ccccc1Cl	C17H20ClNO2	unknown
+COc1cc(CCNCc2ccccc2Cl)cc(OC)c1	C17H20ClNO2	unknown
+COc1cccc(CCNCc2ccccc2Br)c1OC	C17H20BrNO2	unknown
+COc1ccc(CCNCc2ccccc2Br)c(OC)c1	C17H20BrNO2	unknown
+COc1ccc(OC)c(CCNCc2ccccc2Br)c1	C17H20BrNO2	unknown
+COc1cccc(OC)c1CCNCc1ccccc1Br	C17H20BrNO2	unknown
+COc1ccc(CCNCc2ccccc2Br)cc1OC	C17H20BrNO2	unknown
+COc1cc(CCNCc2ccccc2Br)cc(OC)c1	C17H20BrNO2	unknown
+CC(C)N(C)C(=O)[C@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C20H25N3O	unknown
+CCC(=O)N(c1ccccc1)C1CCN(C(=O)OC(C)(C)C)CC1	C19H28N2O3	unknown
+CCCCC(C(=O)c1ccccc1)N(CC)CC	C16H25NO	beta-ketone
+O=Cc1c2ccoc2c(Br)c2ccoc12	C11H5BrO3	unknown
+C/C(=C\c1c2ccoc2c(Br)c2ccoc12)[N+](=O)[O-]	C13H8BrNO4	unknown
+CC(=O)Cc1c2ccoc2c(Br)c2ccoc12	C13H9BrO3	unknown
+O=C1CCCCC1(NCc1ccccc1)c1ccccc1	C19H21NO	unknown
+CCCCCCNC1(c2ccccc2)CCCCC1=O	C18H27NO	unknown
+O=C1CCCCC1(Nc1ccccc1)c1ccccc1	C18H19NO	unknown
+O=C1CCCCC1(Nc1ccc(Cl)cc1)c1ccccc1	C18H18ClNO	unknown
+CC1(NCc2ccccc2)CCCCC1=O	C14H19NO	unknown
+CCCCCCNC1(C)CCCCC1=O	C13H25NO	unknown
+CCCNC1(C)CCCCC1=O	C10H19NO	unknown
+CC(C)NC1(C)CCCCC1=O	C10H19NO	unknown
+CC1(Nc2ccccc2)CCCCC1=O	C13H17NO	unknown
+CC1(Nc2ccc(Cl)cc2)CCCCC1=O	C13H16ClNO	unknown
+O=C(c1ccccc1)C1(NCc2ccccc2)CCCC1	C19H21NO	unknown
+CCCCCCNC1(C(=O)c2ccccc2)CCCC1	C18H27NO	unknown
+CCCNC1(C(=O)c2ccccc2)CCCC1	C15H21NO	unknown
+CC(C)NC1(C(=O)c2ccccc2)CCCC1	C15H21NO	unknown
+O=C(c1ccccc1)C1(Nc2ccccc2)CCCC1	C18H19NO	unknown
+O=C(c1ccccc1)C1(Nc2ccc(Cl)cc2)CCCC1	C18H18ClNO	unknown
+CC(=O)C1(NCc2ccccc2)CCCC1	C14H19NO	unknown
+CCCCCCNC1(C(C)=O)CCCC1	C13H25NO	unknown
+CCCNC1(C(C)=O)CCCC1	C10H19NO	unknown
+CC(=O)C1(NC(C)C)CCCC1	C10H19NO	unknown
+CC(=O)C1(Nc2ccccc2)CCCC1	C13H17NO	unknown
+CC(=O)C1(Nc2ccc(Cl)cc2)CCCC1	C13H16ClNO	unknown
+COc1ccc(C(=O)Oc2cccc3[nH]cc(CCN(C)C)c23)cc1	C20H22N2O3	tryptamine
+CN(C)CCc1c[nH]c2cccc(OC(=O)CC3CC3)c12	C17H22N2O2	tryptamine
+CN(C)CCc1c[nH]c2cccc(OC(=O)c3c(F)c(F)c(F)c(F)c3F)c12	C19H15F5N2O2	tryptamine
+CN(C)CCc1c[nH]c2cccc(OC(=O)c3cccc4c3OCCO4)c12	C21H22N2O4	tryptamine
+CN(C)CCc1c[nH]c2cccc(OC(=O)c3ccc(Br)cc3)c12	C19H19BrN2O2	tryptamine
+COCCOCCOCC(=O)Oc1cccc2[nH]cc(CCN(C)C)c12	C19H28N2O5	tryptamine
+CC(C)[Si](C(C)C)(C(C)C)n1cc(CCN(C)C)c2c(OC(=O)c3ccc(Br)cc3)cccc21	C28H39BrN2O2Si	tryptamine
+CCC(=O)Oc1cccc2c1c(CCN(C)C)cn2[Si](C(C)C)(C(C)C)C(C)C	C24H40N2O2Si	tryptamine
+COC(=O)c1cccc(C(=O)Oc2cccc3[nH]cc(CCN(C)C)c23)c1	C21H22N2O4	tryptamine
+CN(C)CCc1cn(OC(=O)Cc2ccccc2)c2cccc(OC(=O)OCc3ccccc3)c12	C28H28N2O5	tryptamine
+CN(C)CCc1c[nH]c2cccc(OC(=O)OCc3ccccc3)c12	C20H22N2O3	tryptamine
+CN(C)CCc1c[nH]c2cccc(OC(=O)OCC3CC3)c12	C17H22N2O3	tryptamine
+CN(C)CCc1c[nH]c2cccc(OC(=O)OCC(Cl)(Cl)Cl)c12	C15H17Cl3N2O3	tryptamine
+CC(C)[Si](C(C)C)(C(C)C)n1cc(CCN(C)C)c2c(OC(=O)OCC3CC3)cccc21	C26H42N2O3Si	tryptamine
+CN(C)CCc1c[nH]c2cccc(O[Si](C)(C)C(C)(C)C)c12	C18H30N2OSi	tryptamine
+CC(C)[Si](Oc1cccc2[nH]cc(CCN(C)C)c12)(C(C)C)C(C)C	C21H36N2OSi	tryptamine
+CN(C)CCc1c[nH]c2cccc(O[Si](c3ccccc3)(c3ccccc3)C(C)(C)C)c12	C28H34N2OSi	tryptamine
+CC(C)[Si](C(C)C)(C(C)C)n1cc(CCN(C)C)c2c(OC(=O)Sc3ccccc3)cccc21	C28H40N2O2SSi	tryptamine
+CCCC(=O)OCOc1cccc2[nH]cc(CCN(C)C)c12	C17H24N2O3	tryptamine
+CCCCC(=O)OCOc1cccc2[nH]cc(CCN(C)C)c12	C18H26N2O3	tryptamine
+CCC(=O)OCOc1cccc2c1c(CCN(C)C)cn2C(=O)CC	C19H26N2O4	tryptamine
+CN(C)CCc1c[nH]c2cccc(OP(=O)(Oc3ccccc3)Oc3ccccc3)c12	C24H25N2O4P	tryptamine
+CN(C)CCc1c[nH]c2cccc(OP3(=O)OCC(C)(C)CO3)c12	C17H25N2O4P	tryptamine
+CC(C)OC(=O)OCOc1cccc2c1c(CCN(C)C)cn2COC(=O)OC(C)C	C22H32N2O7	tryptamine
+CC(C)[Si](C(C)C)(C(C)C)n1cc(CCN(C)C)c2c(OCc3ccc(F)cc3)cccc21	C28H41FN2OSi	tryptamine
+COc1ccc2[nH]nc(CCN(C)C)c2c1	C12H17N3O	unknown
+[2H]C([2H])(Cc1n[nH]c2ccc(OC)cc12)N(C)C	C12H17N3O	unknown
+CCN(CC)CCc1n[nH]c2ccc(OC)cc12	C14H21N3O	unknown
+COc1ccc2c(c1)c(CCN(C)C)nn2C	C13H19N3O	unknown
+CN(C)CCc1n[nH]c2ccc(Cl)cc12	C11H14ClN3	unknown
+CN(C)CCc1n[nH]c2ccc(O)cc12	C11H15N3O	unknown
+C1=C(c2n[nH]c3ccccc23)CNCC1	C12H13N3	unknown
+CCOC(=O)[C@@H](C)NP(=O)(Oc1ccccc1)Oc1cccc2c1c(CCN(C)C)cn2[Si](C(C)C)(C(C)C)C(C)C	C32H50N3O5PSi	tryptamine
+O=[N+]([O-])c1ccc(CC(N2CCCC2)C(F)(F)F)cc1	C13H15F3N2O2	unknown
+FC(F)(F)C(Cc1ccccc1Br)N1CCCC1	C13H15BrF3N	unknown
+O=[N+]([O-])c1ccccc1CC(N1CCCC1)C(F)(F)F	C13H15F3N2O2	unknown
+CNC(Cc1ccc([N+](=O)[O-])cc1)C(F)(F)F	C10H11F3N2O2	unknown
+CNC(Cc1ccccc1[N+](=O)[O-])C(F)(F)F	C10H11F3N2O2	unknown
+CC(C)NC(Cc1ccc([N+](=O)[O-])cc1)C(F)(F)F	C12H15F3N2O2	unknown
+CC(C)NC(Cc1ccccc1[N+](=O)[O-])C(F)(F)F	C12H15F3N2O2	unknown
+FC(F)(F)C(Cc1ccccc1Br)NCc1ccccc1	C16H15BrF3N	unknown
+COC(=O)c1ccc(CC(NCCc2ccccc2)C(F)(F)F)cc1	C19H20F3NO2	unknown
+Cn1nc(C2=CCCNC2)c2ccccc21	C13H15N3	unknown
+Cn1nc2ccccc2c1C1=CCCNC1	C13H15N3	unknown
+Brc1ccc2[nH]nc(C3=CCCNC3)c2c1	C12H12BrN3	unknown
+Nc1ccc2[nH]nc(C3=CCCNC3)c2c1	C12H14N4	unknown
+COc1ccc2[nH]nc(C3=CCCNC3)c2c1	C13H15N3O	unknown
+c1ccc2c(C3CCCNC3)n[nH]c2c1	C12H15N3	unknown
+C1=C(c2n[nH]c3ccc(-c4ccccc4)cc23)CNCC1	C18H17N3	unknown
+CCNCCc1c[nH]c2cccc(O)c12	C12H16N2O	tryptamine
+CCCNCCc1c[nH]c2cccc(O)c12	C13H18N2O	tryptamine
+CCCCNCCc1c[nH]c2cccc(O)c12	C14H20N2O	tryptamine
+Oc1cccc2[nH]cc(CCNC3CCCCC3)c12	C16H22N2O	tryptamine
+Oc1cccc2[nH]cc(CCNCc3ccccc3)c12	C17H18N2O	tryptamine
+Clc1ccc(-c2n[nH]cc2CN2CCN(C34CC(C3)C4)CC2)cc1	C19H23ClN4	unknown
+CCOC(=O)c1cnc(CNCCc2c[nH]c3cccc(C)c23)s1	C18H21N3O2S	tryptamine
+CC1(C)CCOC1CN1CCOCC1Cc1c[nH]c2ccccc12	C20H28N2O2	unknown
+Cc1cc(C2=CCN(CC3OCCO3)CC2)cc([N+](=O)[O-])c1N	C16H21N3O4	unknown
+COc1cncc(C(=O)N2CC3CCC(N)C3C2)n1	C13H18N4O2	unknown
+OC(c1cccc(C2=CCCNC2)n1)C(F)(F)F	C12H13F3N2O	unknown
+CN1CCC=C(c2cc(F)cc3[nH]ccc23)C1	C14H15FN2	unknown
+CC(c1ncccn1)N1CCCC(c2ccc(O)cc2)C1	C17H21N3O	unknown
+CN(CCc1ccc(O)c(Br)c1)CCc1nccs1	C14H17BrN2OS	unknown
+COc1ccc2[nH]cc(CCN(C)C)c2c1OP(=O)(O)O	C13H19N2O5P	tryptamine
+CCCC(N)C(=O)c1ccc(Cl)cc1	C11H14ClNO	beta-ketone
+CC(N)Cc1c(Cl)cc(N)cc1Cl	C9H12Cl2N2	unknown
+CC(N)Cc1ccc(N)cc1F	C9H13FN2	unknown
+CC(N)Cc1ccc(N)cc1Cl	C9H13ClN2	unknown
+CCc1cc(N)ccc1CC(C)N	C11H18N2	unknown
+Cc1ccc(C#N)cc1OC[C@H](O)CN(C)Cc1ccccc1	C19H22N2O2	unknown
+CCn1cncc1CNC[C@H]1CCN(c2ccc(Br)cc2)C1	C17H23BrN4	unknown
+Cc1c[nH]nc1CN[C@@H]1CCN(c2ccc(Cl)cc2F)C1	C15H18ClFN4	unknown
+C[C@@H]1CN(CCO)CCN1Cc1cccc(Br)c1Cl	C14H20BrClN2O	unknown
+OCCN1CCC[C@@H]2C1CCN2c1nc(-c2ccc(F)cc2)cs1	C18H22FN3OS	unknown
+Fc1ccc(-c2csc(N3CCNCC3)n2)cc1	C13H14FN3S	unknown
+C[C@H]1CN(C)CCN1c1nc(-c2ccc(F)cc2)cs1	C15H18FN3S	unknown
+Brc1ccc(-c2ccnc(C3CC[C@@H](C4CC=CC4)C3)n2)cc1	C20H21BrN2	unknown
+O[C@@H](CN[C@@H]1CCCN(Cc2ccc(F)cc2Cl)C1)c1ccccn1	C19H23ClFN3O	unknown
+O[C@H](CN1CCC[C@@H]1[C@H]1CCCO1)c1coc2ccccc12	C18H23NO3	unknown
+O[C@]1(CNCc2cnn(-c3ccccc3)c2)CCc2ccccc21	C20H21N3O	unknown
+C[C@H]1CN(c2nn3cc(-c4cccnc4)nc3s2)[C@@H](C)CN1CCO	C17H22N6OS	unknown
+C[C@](O)(C[C@H](O)CN[C@H]1C[C@H](c2cccc(C(F)(F)F)c2)C1)C1CC1	C19H26F3NO2	unknown
+COC(=O)[C@H]1CCN(C[C@H](O)Cc2ccc3ccccc3c2)C1	C19H23NO3	unknown
+O[C@H](Cc1ccc2ccccc2c1)CN1C[C@H](O)C2(CC2)C1	C19H23NO2	unknown
+O=c1ccc2ccc(OCCCCN3CCN(c4cccc5sccc45)CC3)cc2[nH]1	C25H27N3O2S	unknown
+Clc1cccc(N2CCN(CCCCOc3ccc4scnc4c3)CC2)c1Cl	C21H23Cl2N3OS	unknown
+COc1cc(CCNCc2ccc3oc4ccccc4c3c2)c(OC)cc1Br	C23H22BrNO3	unknown
+COc1cc(CCNCc2cccc3c2oc2ccccc23)c(OC)cc1Br	C23H22BrNO3	unknown
+COc1cc(CCNCc2cccc3c2oc2ccc(O)cc23)c(OC)cc1Br	C23H22BrNO4	unknown
+COc1ccc2oc3c(CNCCc4cc(OC)c(Br)cc4OC)cccc3c2c1	C24H24BrNO4	unknown
+COc1cc(CCNCc2cccc3c2oc2ccc(C#N)cc23)c(OC)cc1Br	C24H21BrN2O3	unknown
+COc1cc(CCNCc2cccc3c2oc2ccc(Br)cc23)c(OC)cc1Br	C23H21Br2NO3	unknown
+COc1cc(CCNCc2cccc3c2oc2ccc(I)cc23)c(OC)cc1Br	C23H21BrINO3	unknown
+COc1ccc2oc3c(CNCCc4cc(OC)c(Br)cc4OC)cc(OC)cc3c2c1	C25H26BrNO5	unknown
+Cc1[nH]c2c(C)ccc(F)c2c1CCN	C12H15FN2	tryptamine
+NCCc1c[nH]c2cc(OC(F)(F)F)ccc12	C11H11F3N2O	tryptamine
+NCCc1c[nH]c2c(F)cccc12	C10H11FN2	tryptamine
+Cc1[nH]c2c(C(F)(F)F)cccc2c1CCN	C12H13F3N2	tryptamine
+CN1CCc2c[nH]c3ccc(O)c1c23	C11H12N2O	unknown
+C[N+]1(C)CCc2c[nH]c3ccc(O)c1c23	C12H14N2O	unknown
+C[N+]1(C)CCc2c[nH]c3ccc(OS(=O)(=O)O)c1c23	C12H14N2O4S	unknown
+CN1CCc2c[nH]c3c2C1C(=O)C=C3	C11H12N2O	unknown
+CN1CCN(C(=O)[C@@H]2C=C3c4cccc5[nH]cc(c45)C[C@H]3N(C)C2)CC1	C21H26N4O	unknown
+CC(C)[C@@H](CO)NC(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C21H27N3O2	unknown
+CC[C@](C)(CO)NC(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C21H27N3O2	unknown
+COCCNC(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C19H23N3O2	unknown
+COCCCNC(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C20H25N3O2	unknown
+COc1ccc(NC(=O)[C@@H]2C=C3c4cccc5[nH]cc(c45)C[C@H]3N(C)C2)cc1	C23H23N3O2	unknown
+Cc1ccc(NC(=O)[C@@H]2C=C3c4cccc5[nH]cc(c45)C[C@H]3N(C)C2)cc1	C23H23N3O	unknown
+COc1cccc(NC(=O)[C@@H]2C=C3c4cccc5[nH]cc(c45)C[C@H]3N(C)C2)c1	C23H23N3O2	unknown
+COc1ccccc1NC(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C23H23N3O2	unknown
+CN1C[C@H](C(=O)Nc2ccc(Cl)cc2)C=C2c3cccc4[nH]cc(c34)C[C@H]21	C22H20ClN3O	unknown
+CN1C[C@H](C(=O)NC(C)(C)CO)C=C2c3cccc4[nH]cc(c34)C[C@H]21	C20H25N3O2	unknown
+CN1C[C@H](C(=O)NCC(C)(C)O)C=C2c3cccc4[nH]cc(c34)C[C@H]21	C20H25N3O2	unknown
+CC1CCCC(C)N1C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C23H29N3O	unknown
+CC1CCCCN1C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C22H27N3O	unknown
+CN1C[C@H](C(=O)NCC(C)(C)C)C=C2c3cccc4[nH]cc(c34)C[C@H]21	C21H27N3O	unknown
+CN1C[C@H](C(=O)N[C@@H]2CCCC[C@H]2O)C=C2c3cccc4[nH]cc(c34)C[C@H]21	C22H27N3O2	unknown
+CN1C[C@H](C(=O)N[C@@H]2CCCC[C@@H]2O)C=C2c3cccc4[nH]cc(c34)C[C@H]21	C22H27N3O2	unknown
+CC(O)C(C)NC(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C20H25N3O2	unknown
+CN1C[C@H](C(=O)N[C@@H]2CCC[C@H]2O)C=C2c3cccc4[nH]cc(c34)C[C@H]21	C21H25N3O2	unknown
+Cc1ccccc1NC(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C23H23N3O	unknown
+CN1C[C@@H](C(=O)Nc2ccccn2)C=C2c3cccc4[nH]cc(c34)C[C@H]21	C21H20N4O	unknown
+CCO[C@@]12CCC(=O)[C@]3(C)Oc4c(O)ccc5c4[C@@]31CCN(C)[C@@H]2C5	C20H25NO4	unknown
+CO[C@@]12CCC(=O)[C@]3(C)Oc4c(O)ccc5c4[C@@]31CCN(C)[C@@H]2C5	C19H23NO4	unknown
+CCCCCn1nc(C(=O)N[C@H](C(N)=O)C(C)(C)C)c2cc(Br)ccc21	C19H27BrN4O2	cannabinoid
+Cc1c(Br)c(O)c(C(N)=O)c(=O)n1Cc1ccc(F)cc1	C14H12BrFN2O3	unknown
+COc1ccc(Cc2nc3cc([N+](=O)[O-])ccc3n2CCN2CCCCC2)cc1	C22H26N4O3	unknown
+CCCOc1ccc(Cc2nc3cc([N+](=O)[O-])ccc3n2CCN2CCCCC2)cc1	C24H30N4O3	unknown
+COc1ccc2c3c1O[C@H]1[C@@]4(OC)C=C[C@@]5(C[C@@H]4C(C)=O)[C@@H](C2)N(C)CC[C@]315	C23H27NO4	unknown
+O=[N+]([O-])c1ccc2c(c1)nc(Cc1ccc(O)cc1)n2CCN1CCCCC1	C21H24N4O3	unknown
+O=[N+]([O-])c1ccc2c(c1)nc(Cc1ccc(O)cc1)n2CCN1CCCC1	C20H22N4O3	unknown
+CCCC(C(=O)c1cccc(Br)c1)N1CCCC1	C15H20BrNO	beta-ketone
+CCCCn1nc(C(=O)N[C@H](C(=O)O)C(C)(C)C)c2cc(Br)ccc21	C18H24BrN3O3	cannabinoid
+COC(=O)[C@@H](NC(=O)c1n[nH]c2c(Br)cccc12)C(C)(C)C	C15H18BrN3O3	cannabinoid
+[2H]C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])Cn1cc(C(=O)N[C@H](C(N)=O)C(C)(C)C)c2ccccc21	C20H29N3O2	cannabinoid
+[2H]C([2H])([2H])N(C[C@H]1CCCC[C@]1(O)c1cccc(OC)c1)C([2H])([2H])[2H]	C16H25NO2	unknown
+O=C(c1ccc2c(c1)OCO2)C(C1CCCCC1)N1CCCC1	C19H25NO3	beta-ketone
+CC(C)(C)[C@H](NC(=O)c1nn(CCCCCF)c2ccc(Br)cc12)C(N)=O	C19H26BrFN4O2	cannabinoid
+CCC(=O)c1ccc(CC)cc1	C11H14O	unknown
+COc1ccccc1-n1c(C)nc2ccccc2c1=O	C16H14N2O2	unknown
+CCC(C)N(C)CCc1c[nH]c2ccc(OC)cc12	C16H24N2O	tryptamine
+CNC(C)C(=O)c1ccc(CC(C)C)cc1	C14H21NO	beta-ketone
+Cc1c(Br)cn(Cc2ccc(F)cc2)c(=O)c1NC(=O)C1CCCCC1	C20H22BrFN2O2	cannabinoid
+CC(C)(C)OC(=O)N1CCC(Nc2ccc(F)cc2)CC1	C16H23FN2O2	unknown
+Fc1ccccc1C1=NCC(=S)Nc2ccc(Cl)cc21	C15H10ClFN2S	aryldiazepine
+NC(=O)c1n[nH]c2ccc(Br)cc12	C8H6BrN3O	cannabinoid
+CCN(CC)CCn1c(Cc2ccc3c(c2)CCO3)nc2cc([N+](=O)[O-])ccc21	C22H26N4O3	unknown
+CCCOc1ccc(Cc2nc3cc([N+](=O)[O-])ccc3n2CCNCC)cc1	C21H26N4O3	unknown
+CN1CCN(Cc2ccc(F)cc2)CC1	C12H17FN2	unknown
+O=C(O)Cc1cn(Cc2ccc(F)cc2)c2ccccc12	C17H14FNO2	cannabinoid
+CCCCCc1cc(OC(C)=O)c2c(c1)OC(C)(C)[C@@H]1CC=C(C)C[C@@H]21	C23H32O3	unknown
+CCCCCCCc1cc(O)c2c(c1)OC(C)(C)[C@@H]1CC[C@@H](C)C[C@@H]21	C23H36O2	unknown
+C=C(C)[C@@H]1CC[C@@H](C)C[C@H]1c1c(O)cc(CCCCC)cc1O	C21H32O2	unknown
+CC(C)(C)OC(=O)NCC(=O)NCC(=O)Nc1ccc(Br)cc1C(=O)c1ccccc1	C22H24BrN3O5	unknown
+CC(C)(C)OC(=O)NCC(=O)NCC(=O)Nc1ccc(Cl)cc1C(=O)c1ccccc1	C22H24ClN3O5	unknown
+OCc1nnc2n1-c1ccc(Br)cc1C(c1ccccc1Cl)=NC2	C17H12BrClN4O	aryldiazepine
+Cc1nnc2n1-c1ccccc1C(c1ccccc1F)=NC2	C17H13FN4	aryldiazepine
+CN1CCN(Cc2ccccc2F)CC1	C12H17FN2	unknown
+CCCCCCc1cc(O)c2c(c1)OC(C)(C)[C@@H]1CCC(C)C[C@@H]21	C22H34O2	cannabinoid
+COc1ccc(Cc2nc3ccccc3n2CCN2CCCC2)cc1	C21H25N3O	unknown
+CCCNC(CC)C(=O)c1ccccc1	C13H19NO	beta-ketone
+CCNCCn1c(Cc2ccc(OC)cc2)nc2cc([N+](=O)[O-])ccc21	C19H22N4O3	unknown
+CCCCNC(CC)C(=O)c1ccccc1	C14H21NO	beta-ketone
+CCCCCCn1cc(CC(=O)NC2CCCCC2)c2ccccc21	C22H32N2O	cannabinoid
+CC(O)CCCn1cc(CC(=O)NC2CCCCC2)c2ccccc21	C21H30N2O2	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1nc2cc(Br)ccc2[nH]1)C(N)=O	C14H17BrN4O2	cannabinoid
+O=C(N/N=C1\C(=O)N(CCCCCO)c2ccccc21)c1ccccc1	C20H21N3O3	cannabinoid
+CC(C)[C@H](NC(=O)Cc1cn(CC2CCCCC2)c2ccccc12)C(N)=O	C22H31N3O2	cannabinoid
+CCCN(C)C(CC)C(=O)c1ccc2c(c1)OCO2	C15H21NO3	beta-ketone
+CC(C)(C)[C@H](NC(=O)c1n[nH]c2ccccc12)C(=O)O	C14H17N3O3	cannabinoid
+O=C(O)CCCCn1cc(CC(=O)NC2CCCCC2)c2ccccc21	C21H28N2O3	cannabinoid
+CC(C)(C)[C@H](NC(=O)c1nn(CCC[Si](C)(C)C)c2ccccc12)C(N)=O	C20H32N4O2Si	cannabinoid
+Cc1cccc(C(C)c2c[nH]cn2)c1C	C13H16N2	unknown
+CCCCCCCc1cc(OC(C)=O)c2c(c1)OC(C)(C)[C@@H]1CC[C@@H](C)C[C@@H]21	C25H38O3	cannabinoid
+CCCCCCCc1cc(OC(C)=O)c2c(c1)OC(C)(C)[C@@H]1CCC(C)=C[C@@H]21	C25H36O3	cannabinoid
+COC(=O)[C@@H](NC(=O)c1c[nH]c2ccccc12)C(C)(C)C	C16H20N2O3	cannabinoid
+CCCCCc1cc(OC(C)=O)c2c(c1)OC(C)(C)c1ccc(C)cc1-2	C23H28O3	unknown
+O=C(Cc1cn(Cc2ccc(F)cc2)c2ccccc12)NCC1CCCCC1	C24H27FN2O	cannabinoid
+NCC(CC(=O)O)c1ccc(Br)cc1	C10H12BrNO2	unknown
+CCC(=O)N(CCc1ccccc1)c1ccccc1	C17H19NO	unknown
+CCn1cc(CCN(C)C)c2c(O)cccc21	C14H20N2O	tryptamine
+CN(C)CCc1cn(CC(F)F)c2cccc(O)c12	C14H18F2N2O	tryptamine
+CN(C)CCc1cn(CC2CC2)c2cccc(O)c12	C16H22N2O	tryptamine
+CN1C[C@H](CO)C=C2c3cc(F)cc4[nH]cc(c34)C[C@H]21	C16H17FN2O	tryptamine
+C[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C16H18N2	unknown
+c1ccc(Oc2noc3c2CCNCC3)cc1	C13H14N2O2	unknown
+C[C@@H]1C=C(c2c[nH]c3ncccc23)CN(C)C1	C14H17N3	unknown
+CC(C)NNC(=O)c1ccncc1	C9H13N3O	unknown
+CN(C)CCC[C@@]1(c2ccc(F)cc2)OCc2cc(C#N)ccc21	C20H21FN2O	unknown
+CCCCc1ccc2[nH]cc(CCN)c2c1	C14H20N2	tryptamine
+Cc1[nH]c2c(C)cccc2c1CCN	C12H16N2	tryptamine
+CC(=O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@](C)(O)CC[C@]4(C)[C@H]3CC[C@]12C	C22H36O2	unknown
+COc1ccc(-n2nccn2)c(C(=O)N2CCC[C@@]2(C)c2nc3c(C)c(Cl)ccc3[nH]2)c1	C23H23ClN6O2	unknown
+C[C@@]1(O)CC[C@H]2[C@H](CC[C@@H]3[C@@H]2CC[C@]2(C)[C@@H](C(=O)Cn4cc(C#N)cn4)CC[C@@H]32)C1	C25H35N3O2	unknown
+COC(=O)[C@H](c1ccccc1)[C@H]1CCCCN1C(=O)OC[n+]1cccc(C(=O)N[C@@H](CO)C(=O)O)c1	C25H29N3O8	unknown
+C=CCN1C[C@H](C(=O)N(CC)CC)C=C2c3cccc4c3c(cn4C(=O)c3cccs3)C[C@H]21	C27H29N3O2S	unknown
+CCC(=O)N(c1ccccc1F)C1CCN(CCc2ccccc2F)CC1C	C23H28F2N2O	unknown
+CNC(C(C)=O)c1cccc(C)c1	C11H15NO	unknown
+CNCC1CCCCC1(O)c1cccc(OC)c1	C15H23NO2	unknown
+COc1cccc(C2(O)CCCCC2CN(C)Cc2ccccc2)c1	C22H29NO2	unknown
+Cc1nnc2n1-c1ccc(F)cc1C(c1ccccc1Cl)=NC2	C17H12ClFN4	unknown
+O=C1CN=C(c2ccccc2Cl)c2cc(F)ccc2N1	C15H10ClFN2O	unknown
+CCN(CC)CCn1c(Cc2ccc(OC)cc2)nc2cc(C)ccc21	C22H29N3O	unknown
+COc1ccc2c3c1O[C@H]1[C@@H](O)CC[C@H]4[C@@H](C2)NCC[C@@]341	C17H21NO3	unknown
+O=C(N/N=C1\C(=O)N(CC2CCC(O)CC2)c2ccccc21)c1ccccc1	C22H23N3O3	unknown
+O=C(N/N=C1\C(=O)N(CCCC(O)CO)c2ccccc21)c1ccccc1	C20H21N3O4	unknown
+CCCCCc1cc(OC(C)=O)c(C/C=C(\C)CCC=C(C)C)c(OC(C)=O)c1	C25H36O4	unknown
+Cc1ccccc1NC1CCN(C(=O)OC(C)(C)C)CC1	C17H26N2O2	unknown
+CNC(=O)Oc1cccc2ccccc12	C12H11NO2	unknown
+O=C1OCCC1Br	C4H5BrO2	unknown
+CCCCCCCCc1cc(O)c2c(c1)OC(C)(C)[C@@H]1CCC(C)=C[C@@H]21	C24H36O2	unknown
+CCCCCc1cc(O)c2c(c1)OC(C)(C)[C@@H]1CCC(C)=C(O)[C@@H]21	C21H30O3	unknown
+CCCC(=O)N1CCN(C/C=C/c2ccc(O)cc2)CC1C	C18H26N2O2	unknown
+C=CCCCn1nc(C(=O)N[C@H](C(=O)OC)C(C)(C)C)c2cc(Br)ccc21	C20H26BrN3O3	unknown
+COC(=O)[C@@H](NC(=O)c1nn(C)c2ccccc12)C(C)(C)C	C16H21N3O3	unknown
+COC(=O)[C@@H](NC(=O)c1n[nH]c2ccc(C)cc12)C(C)(C)C	C16H21N3O3	unknown
+O=c1c2ccccc2nc(CCl)n1-c1ccccc1	C15H11ClN2O	unknown
+Clc1ccc2nsnc2c1NC1=NCCN1	C9H8ClN5S	unknown
+CCNC1(c2ccc(F)cc2)CCCCC1=O	C14H18FNO	unknown
+CCCCN(C)C(CC)C(=O)c1ccccc1	C15H23NO	beta-ketone
+CCCCNC(CCC)C(=O)c1ccccc1	C15H23NO	beta-ketone
+CCC1(c2cccc(O)c2)CCCCN(C)C1	C15H23NO	unknown
+CCCCCCCc1cc(O)c2c(c1)OC(C)(C)[C@@H]1CC=C(C)C[C@@H]21	C23H34O2	unknown
+CCCCCc1cc(O)c2c(c1)OC(C)(C)[C@@H]1CC[C@@](C)(O)C[C@@H]21	C21H32O3	unknown
+CC(C)C(NC(=O)c1n[nH]c2ccccc12)C(N)=O	C13H16N4O2	unknown
+CCC(=O)N1CCC(N(C(=O)CC)c2ccc(F)cc2)CC1	C17H23FN2O2	unknown
+c1ccc(CNC2CCCCC2)cc1	C13H19N	unknown
+CC(c1ccc(Cl)cc1)N1CCC(n2c(=O)n(CCC#N)c3ccccc32)CC1	C23H25ClN4O	unknown
+CC(=O)Oc1cccc2[nH]cc(CCN(C)C3CC3)c12	C16H20N2O2	unknown
+CCCCn1cc(C(=O)NC(C(=O)OC)C(C)(C)C)c2ccccc21	C20H28N2O3	unknown
+CCCC(=O)N(c1ccccc1OC)C1CCN(CCc2ccccc2)CC1	C24H32N2O2	unknown
+CCc1cc(C(=O)c2ccccc2Cl)c(NC(=O)CN)s1	C15H15ClN2O2S	unknown
+CC(C)N(C)C(C)C(=O)c1ccc2c(c1)OCO2	C14H19NO3	beta-ketone
+Cc1cc(Cl)ccc1-n1c(C)nc2ccccc2c1=O	C16H13ClN2O	unknown
+NCC(=O)NCC(=O)Nc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1Cl	C17H15ClN4O5	unknown
+NCC(=O)Nc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1Cl	C15H12ClN3O4	unknown
+NCC(=O)Nc1ccc(Cl)cc1C(=O)c1ccccc1Cl	C15H12Cl2N2O2	unknown
+CCCCn1nc(C(N)=O)c2ccccc21	C12H15N3O	unknown
+COc1cccc(C2(O)CCCCC2C[N+](C)(C)[O-])c1	C16H25NO3	unknown
+NCc1cc(O)ns1	C4H6N2OS	unknown
+NCC(=O)Nc1ccc(Cl)cc1C(=O)c1ccccc1	C15H13ClN2O2	unknown
+CCN(CC)CCn1c(Cc2ccc3c(c2)OCO3)nc2cc([N+](=O)[O-])ccc21	C21H24N4O4	unknown
+NC1CC1c1ccc(F)c(F)c1	C9H9F2N	unknown
+CCCCc1cc2c(c(O)c1C(=O)O)[C@@H]1CC(C)=CC[C@H]1C(C)(C)O2	C21H28O4	unknown
+Cc1cccc(NC2CCN(C(=O)OC(C)(C)C)CC2)c1	C17H26N2O2	unknown
+Cc1ccc(NC2CCN(C(=O)OC(C)(C)C)CC2)cc1	C17H26N2O2	unknown
+CCCC(=O)c1ccc(C)cc1	C11H14O	unknown
+CCN(CC)CCn1c(Cc2ccc(OC)c(OC)c2)nc2ccccc21	C22H29N3O2	unknown
+CCN(CC)C(=O)Cc1c[nH]c2ccccc12	C14H18N2O	unknown
+Cc1ccc(C(=O)Oc2cccc3ccccc23)cc1S(=O)(=O)N(C)C	C20H19NO4S	unknown
+CNC(C)Cc1ccc2nonc2c1	C10H13N3O	unknown
+CNC(C)Cc1ccc2nsnc2c1	C10H13N3S	unknown
+COc1cc(S(=O)C(F)(F)F)c(OC)cc1CCN	C11H14F3NO3S	unknown
+COc1cc(S(=O)(=O)C(F)(F)F)c(OC)cc1CCN	C11H14F3NO4S	unknown
+COc1cc(S(=O)C(F)F)c(OC)cc1CCN	C11H15F2NO3S	unknown
+COc1cc(S(=O)(=O)C(F)F)c(OC)cc1CCN	C11H15F2NO4S	unknown
+COc1cc(SSC(F)(F)F)c(OC)cc1CCN	C11H14F3NO2S2	unknown
+COc1cc(S(=O)(=O)CF)c(OC)cc1CCN	C11H16FNO4S	unknown
+COc1cc(SSC(C)(C)C)c(OC)cc1CCN	C14H23NO2S2	unknown
+COc1cc(SCCC(F)(F)F)c(OC)cc1CCN	C13H18F3NO2S	unknown
+COc1cc(SCCC(F)F)c(OC)cc1CCN	C13H19F2NO2S	unknown
+COc1cc(SCC(F)(F)C(F)F)c(OC)cc1CCN	C13H17F4NO2S	unknown
+COc1cc(OCCC(F)(F)F)c(OC)cc1CCN	C13H18F3NO3	unknown
+COc1cc(OCCC(F)F)c(OC)cc1CCN	C13H19F2NO3	unknown
+COc1cc(OCCCF)c(OC)cc1CCN	C13H20FNO3	unknown
+COc1cc([Se]C(F)(F)F)c(OC)cc1CCN	C11H14F3NO2Se	unknown
+C#CCCCSc1cc(OC)c(CCN)cc1OC	C15H21NO2S	unknown
+COc1cc(SCC#N)c(OC)cc1CCN	C12H16N2O2S	unknown
+COc1cc(CCN)cc(OC)c1SC(F)(F)F	C11H14F3NO2S	unknown
+COc1cc(SC(F)(F)F)c(OC)cc1CC(C)N	C12H16F3NO2S	unknown
+COc1cc(SC(F)(F)F)c(OC)cc1CCNCC1CC1	C15H20F3NO2S	unknown
+COc1cc(C(=O)C(C)(C)C)c(OC)cc1CCN	C15H23NO3	unknown
+COc1cc(N(C(C)C)C(C)C)c(OC)cc1CCN	C16H28N2O2	unknown
+COc1cc(P(C)(C)=O)c(OC)cc1CCN	C12H20NO3P	unknown
+COc1cc(C2CCCC2)c(OC)cc1CCN	C15H23NO2	unknown
+COc1cc(S(=O)(=O)C(C)(C)C)c(OC)cc1CCN	C14H23NO4S	unknown
+CCOC(=O)n1cc2c3c(cccc31)C1=C[C@@H](C(=O)N(CC)CC)CN(C)[C@@H]1C2	C23H29N3O3	unknown
+CCCCCCCCCCCC(=O)n1cc2c3c(cccc31)C1=C[C@@H](C(=O)N(CC)CC)CN(C)[C@@H]1C2	C32H47N3O2	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)c3ccco3)C[C@H]2N(C)C1	C25H27N3O3	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)CCc3ccccc3)C[C@H]2N(C)C1	C29H33N3O2	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)c3ccccc3C)C[C@H]2N(C)C1	C28H31N3O2	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)c3cccnc3)C[C@H]2N(C)C1	C26H28N4O2	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)CCC(=O)OC)C[C@H]2N(C)C1	C25H31N3O4	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)OC(C)OC(=O)C(C)C)C[C@H]2N(C)C1	C27H35N3O5	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4S(=O)(=O)C3CC3)C[C@H]2N(C)C1	C23H29N3O3S	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)COC)C[C@H]2N(C)C1	C23H29N3O3	unknown
+CCC(=O)n1c(Br)c2c3c(cccc31)C1=C[C@@H](C(=O)N(CC)CC)CN(C)[C@@H]1C2	C23H28BrN3O2	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)c3ccccc3)C[C@H]2N(C)C1	C27H29N3O2	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)Cc3ccccc3)C[C@H]2N(C)C1	C28H31N3O2	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)C34CC5CC(CC(C5)C3)C4)C[C@H]2N(C)C1	C31H39N3O2	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)C(C)(C)C)C[C@H]2N(C)C1	C25H33N3O2	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)CC(C)C)C[C@H]2N(C)C1	C25H33N3O2	unknown
+CCCCCC(=O)n1cc2c3c(cccc31)C1=C[C@@H](C(=O)N(CC)CC)CN(C)[C@@H]1C2	C26H35N3O2	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)CCC3CCCC3)C[C@H]2N(C)C1	C28H37N3O2	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)C3CCCCC3)C[C@H]2N(C)C1	C27H35N3O2	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)C3CCCC3)C[C@H]2N(C)C1	C26H33N3O2	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)C3CCC3)C[C@H]2N(C)C1	C25H31N3O2	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)C(C)C)C[C@H]2N(C)C1	C24H31N3O2	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)c3ccc(C)o3)C[C@H]2N(C)C1	C26H29N3O3	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)c3ccc(C(C)(C)C)o3)C[C@H]2N(C)C1	C29H35N3O3	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)C3CCCO3)C[C@H]2N(C)C1	C25H31N3O3	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)c3ccoc3)C[C@H]2N(C)C1	C25H27N3O3	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)c3ccsc3)C[C@H]2N(C)C1	C25H27N3O2S	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)c3ccncc3)C[C@H]2N(C)C1	C26H28N4O2	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)C3COC3)C[C@H]2N(C)C1	C24H29N3O3	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)C3CCOCC3)C[C@H]2N(C)C1	C26H33N3O3	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)CCCN3CCOCC3)C[C@H]2N(C)C1	C28H38N4O3	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)N3CCOCC3)C[C@H]2N(C)C1	C25H32N4O3	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4S(=O)(=O)c3ccc(C)cc3)C[C@H]2N(C)C1	C27H31N3O3S	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)OC(C)(C)C)C[C@H]2N(C)C1	C25H33N3O3	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)OCc3ccccc3)C[C@H]2N(C)C1	C28H31N3O3	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)C3C4CC3C4)C[C@H]2N(C)C1	C26H31N3O2	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)C3C(C)(C)C3(C)C)C[C@H]2N(C)C1	C28H37N3O2	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)C(C)C(C)(C)C)C[C@H]2N(C)C1	C27H37N3O2	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)CC3CCOCC3)C[C@H]2N(C)C1	C27H35N3O3	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)COC(C)C)C[C@H]2N(C)C1	C25H33N3O3	unknown
+CCOCCC(=O)n1cc2c3c(cccc31)C1=C[C@@H](C(=O)N(CC)CC)CN(C)[C@@H]1C2	C25H33N3O3	unknown
+C#CCCC(=O)n1cc2c3c(cccc31)C1=C[C@@H](C(=O)N(CC)CC)CN(C)[C@@H]1C2	C25H29N3O2	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)C3CC=CC3)C[C@H]2N(C)C1	C26H31N3O2	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)CCSC)C[C@H]2N(C)C1	C24H31N3O2S	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)CC3C=CCC3)C[C@H]2N(C)C1	C27H33N3O2	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)c3cc4ccccc4s3)C[C@H]2N(C)C1	C29H29N3O2S	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)C3CC4(CCC4)C3)C[C@H]2N(C)C1	C28H35N3O2	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)C(F)(F)F)C[C@H]2N(C)C1	C22H24F3N3O2	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)CN3CCCC3)C[C@H]2N(C)C1	C26H34N4O2	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)c3cc4sccc4s3)C[C@H]2N(C)C1	C27H27N3O2S2	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)C3CCCOC3)C[C@H]2N(C)C1	C26H33N3O3	unknown
+C=CCC(=O)n1cc2c3c(cccc31)C1=C[C@@H](C(=O)N(CC)CC)CN(C)[C@@H]1C2	C24H29N3O2	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)C3CCCS3)C[C@H]2N(C)C1	C25H31N3O2S	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)C3CCOC3)C[C@H]2N(C)C1	C25H31N3O3	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)CSC)C[C@H]2N(C)C1	C23H29N3O2S	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)c3ccc(Br)s3)C[C@H]2N(C)C1	C25H26BrN3O2S	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)C3(C)CC34CCC4C)C[C@H]2N(C)C1	C29H37N3O2	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)C3(C)C4CC43C)C[C@H]2N(C)C1	C27H33N3O2	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)CCC(C)=O)C[C@H]2N(C)C1	C25H31N3O3	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)c3cc[se]c3)C[C@H]2N(C)C1	C25H27N3O2Se	unknown
+CNC(C)Cc1ccc2n[se]nc2c1	C10H13N3Se	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(c(Br)n4C(=O)CCc3ccccc3)C[C@H]2N(C)C1	C29H32BrN3O2	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)C34CCN(CC3)CC4)C[C@H]2N(C)C1	C28H36N4O2	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)CC3CCCCC3)C[C@H]2N(C)C1	C28H37N3O2	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)CCC(=O)O)C[C@H]2N(C)C1	C24H29N3O4	unknown
+CCCCCCCCCCCCCCCCCC(=O)n1cc2c3c(cccc31)C1=C[C@@H](C(=O)N(CC)CC)CN(C)[C@@H]1C2	C38H59N3O2	unknown
+CCCCCCCC/C=C\CCCCCCCC(=O)n1cc2c3c(cccc31)C1=C[C@@H](C(=O)N(CC)CC)CN(C)[C@@H]1C2	C38H57N3O2	unknown
+CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)n1cc2c3c(cccc31)C1=C[C@@H](C(=O)N(CC)CC)CN(C)[C@@H]1C2	C40H55N3O2	unknown
+CCCCC/C=C\C/C=C\CCCCCCCC(=O)n1cc2c3c(cccc31)C1=C[C@H](C(=O)N(CC)CC)CN(C)[C@@H]1C2	C38H55N3O2	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)[C@@H](N)C(C)C)C[C@H]2N(C)C1	C25H34N4O2	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)NC)C[C@H]2N(C)C1	C22H28N4O2	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(c(Br)n4C(=O)c3ccco3)C[C@H]2N(C)C1	C25H26BrN3O3	unknown
+C=CCN1C[C@H](C(=O)N(C)C(C)C)C=C2c3cccc4c3c(cn4C(=O)CC)C[C@H]21	C25H31N3O2	unknown
+COc1cc(SC(F)F)c(OC)cc1C=O	C10H10F2O3S	unknown
+COc1cc(SC(F)F)c(OC)cc1/C=C/[N+](=O)[O-]	C11H11F2NO4S	unknown
+COc1cc(SCCC(F)(F)F)c(OC)cc1C=O	C12H13F3O3S	unknown
+COc1cc(SCCC(F)(F)F)c(OC)cc1/C=C/[N+](=O)[O-]	C13H14F3NO4S	unknown
+COc1cc(SCCC(F)F)c(OC)cc1C=O	C12H14F2O3S	unknown
+COc1cc(SCCC(F)F)c(OC)cc1/C=C/[N+](=O)[O-]	C13H15F2NO4S	unknown
+COc1cc(SCC(F)(F)C(F)F)c(OC)cc1C=O	C12H12F4O3S	unknown
+COc1cc(SCC(F)(F)C(F)F)c(OC)cc1/C=C/[N+](=O)[O-]	C13H13F4NO4S	unknown
+COc1cc(OCCC(F)(F)F)c(OC)cc1C=O	C12H13F3O4	unknown
+COc1cc(OCCC(F)(F)F)c(OC)cc1/C=C/[N+](=O)[O-]	C13H14F3NO5	unknown
+COc1cc(OCCC(F)F)c(OC)cc1C=O	C12H14F2O4	unknown
+COc1cc(OCCC(F)F)c(OC)cc1/C=C/[N+](=O)[O-]	C13H15F2NO5	unknown
+COc1cc(OCCCF)c(OC)cc1C=O	C12H15FO4	unknown
+COc1cc(OCCCF)c(OC)cc1/C=C/[N+](=O)[O-]	C13H16FNO5	unknown
+COc1cc(C=O)cc(OC)c1SC(F)(F)F	C10H9F3O3S	unknown
+COc1cc(/C=C/[N+](=O)[O-])cc(OC)c1SC(F)(F)F	C11H10F3NO4S	unknown
+COc1cc(SC(F)(F)F)c(OC)cc1C=O	C10H9F3O3S	unknown
+COc1cc(SC(F)(F)F)c(OC)cc1/C=C(\C)[N+](=O)[O-]	C12H12F3NO4S	unknown
+COc1cc(N(C(C)C)C(C)C)c(OC)cc1C=O	C15H23NO3	unknown
+COc1cc(N(C(C)C)C(C)C)c(OC)cc1/C=C/[N+](=O)[O-]	C16H24N2O4	unknown
+COc1cc(C2=CCCC2)c(OC)cc1C=O	C14H16O3	unknown
+COc1cc(C2=CCCC2)c(OC)cc1/C=C/[N+](=O)[O-]	C15H17NO4	unknown
+COc1cc(SC)c(OC)cc1CC(C)NS(=O)C(C)(C)C	C16H27NO3S2	unknown
+O=C(C[C@@H]1NCCC[C@H]1O)Cn1cnc2ccccc2c1=O	C16H19N3O3	unknown
+Oc1ccc2c(c1)[C@@]13CCCC[C@H]1[C@@H](C2)NCC3	C16H21NO	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)CCC(C)C)C[C@H]2N(C)C1	C26H35N3O2	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)O[C@H](OC(=O)C(C)C)C(C)C)C[C@H]2N(C)C1	C29H39N3O5	unknown
+CCC(=O)n1cc2c3c(cccc31)C1=C[C@@H](C(=O)N(CC)C(C)C)CN(C)[C@@H]1C2	C24H31N3O2	unknown
+CCC(=O)n1cc2c3c(cccc31)C1=C[C@@H](C(=O)N3[C@@H](C)C[C@@H]3C)CN(C)[C@@H]1C2	C24H29N3O2	unknown
+CC(C)N(C)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)c3ccco3)C[C@H]2N(C)C1	C25H27N3O3	unknown
+C[C@H]1C[C@H](C)N1C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)c3ccco3)C[C@H]2N(C)C1	C26H27N3O3	unknown
+C=CCN1C[C@H](C(=O)N2[C@@H](C)C[C@@H]2C)C=C2c3cccc4c3c(cn4C(=O)CC)C[C@H]21	C26H31N3O2	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(c(Br)n4C(=O)C3CC3)C[C@H]2N(C)C1	C24H28BrN3O2	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(c(Br)n4C(=O)CCC3CCCC3)C[C@H]2N(C)C1	C28H36BrN3O2	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)c3ccco3)C[C@H]2N(CC)C1	C26H29N3O3	unknown
+C=CCN1C[C@H](C(=O)N(CC)CC)C=C2c3cccc4c3c(cn4C(=O)c3ccco3)C[C@H]21	C27H29N3O3	unknown
+CCC(=O)n1c(F)c2c3c(cccc31)C1=C[C@@H](C(=O)N(CC)CC)CN(C)[C@@H]1C2	C23H28FN3O2	unknown
+CC(=O)n1cc2c3c(cccc31)C1=C[C@@H](C(=O)N(C)C(C)C)CN(C)[C@@H]1C2	C22H27N3O2	unknown
+CC(=O)n1cc2c3c(cccc31)C1=C[C@@H](C(=O)N3CCOCC3)CN(C)[C@@H]1C2	C22H25N3O3	unknown
+CCC(=O)n1cc2c3c(cccc31)C1=C[C@@H](C(=O)N(CC)C3CC3)CN(C)[C@@H]1C2	C24H29N3O2	unknown
+CCC(=O)n1cc2c3c(cccc31)C1=C[C@@H](C(=O)N3[C@@H](C)CC[C@@H]3C)CN(C)[C@@H]1C2	C25H31N3O2	unknown
+C[C@H]1CC[C@H](C)N1C(=O)[C@@H]1C=C2c3cccc4c3c(cn4C(=O)C3CC3)C[C@H]2N(C)C1	C26H31N3O2	unknown
+CCC(=O)n1cc2c3c(cccc31)C1=C[C@@H](C(=O)N(CC)CC)CN(CCF)[C@@H]1C2	C24H30FN3O2	unknown
+C=C(C)CN1C[C@H](C(=O)N(CC)CC)C=C2c3cccc4c3c(cn4C(=O)CC)C[C@H]21	C26H33N3O2	unknown
+CCC(=O)n1cc2c3c(cccc31)C1=C[C@@H](C(=O)N(CC)CC)CN(CC3CC3)[C@@H]1C2	C26H33N3O2	unknown
+CCN1C[C@H](C(=O)N(C)C(C)C)C=C2c3cccc4c3c(cn4C(=O)c3cccs3)C[C@H]21	C26H29N3O2S	unknown
+CCC(=O)n1c(C)c2c3c(cccc31)C1=C[C@@H](C(=O)N(CC)CC)CN(C)[C@@H]1C2	C24H31N3O2	unknown
+CCC(=O)n1c(C2CC2)c2c3c(cccc31)C1=C[C@@H](C(=O)N(CC)CC)CN(C)[C@@H]1C2	C26H33N3O2	unknown
+CNC(C(=O)c1ccccc1)C1CCCCC1	C15H21NO	beta-ketone
+C[C@H](N)Cn1ncc2ccc3c(c21)C[C@@H](O)CO3	C13H17N3O2	cannabinoid
+C[C@H](N)Cn1ncc2ccc3c(c21)C[C@@H](N)CO3	C13H18N4O	cannabinoid
+C[C@H](N)Cn1ncc2ccc3c(c21)C[C@@H](OCCN)CO3	C15H22N4O2	cannabinoid
+C[C@H](N)Cn1ncc2ccc3c(c21)C[C@@H](OCCO)CO3	C15H21N3O3	unknown
+CNC(=O)CO[C@H]1COc2ccc3cnn(C[C@H](C)N)c3c2C1	C16H22N4O3	unknown
+COCCNC(=O)CO[C@H]1COc2ccc3cnn(C[C@H](C)N)c3c2C1	C18H26N4O4	unknown
+C[C@H](N)Cn1ncc2ccc3c(c21)C[C@@H](OCC(=O)NCCCN)CO3	C18H27N5O3	unknown
+C[C@H](N)Cn1ncc2ccc3c(c21)C[C@@H](OCC(=O)N1CCN(c2ccccn2)CC1)CO3	C24H30N6O3	unknown
+FC(F)(F)c1ccc(C2CCCNC2)cc1	C12H14F3N	unknown
+Cc1c(C(=O)NC(C)(C)c2ccccc2)c2ccccc2n1CCCCCF	C24H29FN2O	cannabinoid
+Cc1c(C(=O)On2nnc3ccccc32)c2ccccc2n1CCCCCF	C21H21FN4O2	cannabinoid
+O=C(On1nnc2ccccc21)c1cn(CCCCCF)c2ccccc12	C20H19FN4O2	cannabinoid
+O=C(On1nnc2ccccc21)c1nn(CCCCCF)c2ccccc12	C19H18FN5O2	cannabinoid
+CCCCCn1cc(C(=O)On2nnc3ccccc32)c2cccnc21	C19H19N5O2	cannabinoid
+O=C(On1nnc2ccccc21)c1cn(CC2CCCCC2)c2ncccc12	C21H21N5O2	cannabinoid
+O=C(On1nnc2ccccc21)c1cn(Cc2ccc(F)cc2)c2ncccc12	C21H14FN5O2	cannabinoid
+Cc1cc(C(=O)NNCc2ccccc2)no1	C12H13N3O2	unknown
+COc1ccc2[nH]cc(CCN3CC=CC3)c2c1	C15H18N2O	tryptamine
+O=C1CCCCC1(NC1CC1)c1ccccc1	C15H19NO	arylcycloalkylamine
+Cc1cc(C(C)(C)C)c(O)c(C)c1CC1=NCCN1	C16H24N2O	unknown
+CN1CCN(C2=Nc3ccccc3Cc3ccccc32)CC1	C19H21N3	unknown
+CN1CCN(C2=Nc3ccccc3Nc3ccccc32)CC1	C18H20N4	unknown
+CN1CCC2=C(C1)c1ccccc1Cc1ccccc12	C19H19N	unknown
+NC1=NCC2c3ccccc3Nc3ccccc3N12	C15H14N4	unknown
+C[C@H]1CC[C@H]2[C@H](C1)c1c(O)cc(/C=C/c3ccccc3)cc1OC2(C)C	C24H28O2	cannabinoid
+Cc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)CC21	C17H24O2	cannabinoid
+CCCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)CC21	C19H28O2	cannabinoid
+CCCCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)CC21	C20H30O2	cannabinoid
+CCCCCCCCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)CC21	C24H38O2	cannabinoid
+CCCCCC(C)C(C)c1cc(O)c2c(c1)OC(C)C1CCC(C)CC21	C24H38O2	cannabinoid
+CCCCCc1cc(OC(C)=O)c2c(c1)OC(C)(C)[C@@H]1CCCCC[C@@H]21	C23H34O3	cannabinoid
+CC(CCCc1ccccc1)Oc1cc(O)c2c(c1)OC(C)(C)[C@@H]1CC[C@@H](O)C[C@@H]21	C26H34O4	cannabinoid
+Cc1cc(O)c2c(c1)OC(C)(C)[C@@H]1CC[C@H](C)C[C@@H]21	C17H24O2	cannabinoid
+CCCCCc1cc(O)c2c(c1)OC(C)(C)[C@@H]1CCC(CO)C[C@@H]21	C21H32O3	cannabinoid
+CCCCCc1cc(O)c2c(c1)OC(C)(C)[C@@H]1CCC(C(=O)O)C[C@@H]21	C21H30O4	cannabinoid
+CCCCCn1nc(C(=O)N[C@@](C)(CC)C(N)=O)c2ccccc21	C18H26N4O2	cannabinoid
+CC[C@](C)(NC(=O)c1nn(CC2CCCCC2)c2ccccc12)C(N)=O	C20H28N4O2	cannabinoid
+CC[C@](C)(NC(=O)c1nn(Cc2ccc(F)cc2)c2ccccc12)C(=O)OC	C21H22FN3O3	cannabinoid
+CCCC[C@H](NC(=O)c1nn(CCCCCF)c2ccccc12)C(=O)OC	C20H28FN3O3	cannabinoid
+COC(=O)[C@H](CC(C)C)NC(=O)c1nn(CCCCCF)c2ccccc12	C20H28FN3O3	cannabinoid
+CCC[C@](C)(NC(=O)c1nn(CCCCCF)c2ccccc12)C(=O)OC	C20H28FN3O3	cannabinoid
+COC(=O)[C@@](C)(NC(=O)c1nn(CCCCCF)c2ccccc12)C(C)C	C20H28FN3O3	cannabinoid
+CCC(CC)(NC(=O)c1nn(CCCCCF)c2ccccc12)C(=O)OC	C20H28FN3O3	cannabinoid
+CN1C2CC(OC(=O)c3ccccc3)CC1C(O)C2O	C15H19NO4	unknown
+CN1C2CCC1CC(OC(=O)/C=C/c1ccccc1)C2	C17H21NO2	unknown
+COc1ccc(C(=O)OC2CC3CCC(C2)N3C)cc1	C16H21NO3	unknown
+C/C=C(\C)C(=O)OC1CC2C=CC(C1)N2C	C13H19NO2	unknown
+COc1ccc(C(=O)OC2CC3CCC(C2)N3CCO)cc1OC	C18H25NO5	unknown
+CC(C)C(=O)O[C@@H]1CC2CC(OC(=O)c3ccccc3)C(C1)N2	C18H23NO4	unknown
+COC1C2CCC(C[C@@H]1OC(=O)c1ccccc1)N2C	C16H21NO3	unknown
+CN1C(=O)[C@H](O)C[C@H]1c1cccnc1	C10H12N2O2	unknown
+Cc1nnc(CN)n1-c1ccc(Cl)cc1C(=O)c1ccccc1	C17H15ClN4O	aryldiazepine
+COc1cc(C(O)C[N+](=O)[O-])cc(OC)c1OC	C11H15NO6	unknown
+COc1ccc(C(O)C(C)[N+](=O)[O-])cc1	C10H13NO4	unknown
+CC(C(O)c1ccc2c(c1)OCO2)[N+](=O)[O-]	C10H11NO5	unknown
+COc1ccc(OC)c(C(O)C(C)[N+](=O)[O-])c1	C11H15NO5	unknown
+COc1cc(C(O)C(C)[N+](=O)[O-])cc(OC)c1OC	C12H17NO6	unknown
+OC1(c2c3c(c(Br)c4c2OCC4)OCC3)CNC1	C13H14BrNO3	unknown
+COC1(c2c3c(c(Br)c4c2OCC4)OCC3)CNC1	C14H16BrNO3	unknown
+CN1CC(c2c3c(c(Br)c4c2OCC4)OCC3)C1	C14H16BrNO2	unknown
+c1ccc(C2CNC2)cc1	C9H11N	unknown
+CN1CC(c2ccccc2)C1	C10H13N	unknown
+COC1(c2ccccc2)CN(C)C1	C11H15NO	unknown
+COC1(c2ccccc2)CN(C(=O)OC(C)(C)C)C1	C15H21NO3	unknown
+COc1ccc(OC)c(C2CNC2)c1	C11H15NO2	unknown
+COc1ccc(OC)c(C2(O)CNC2)c1	C11H15NO3	unknown
+COc1ccc(OC)c(C2(OC)CNC2)c1	C12H17NO3	unknown
+COc1cc(C2CN[C@@H]2C)c(OC)cc1Br	C12H16BrNO2	unknown
+COc1cc(C2CN[C@H]2C)c(OC)cc1Br	C12H16BrNO2	unknown
+COc1cc(C2CNC2)c(OCc2ccccc2)cc1Br	C17H18BrNO2	unknown
+COc1cc(Br)c(OCc2ccccc2)cc1C1CNC1	C17H18BrNO2	unknown
+CC(C)c1cc(OCc2ccccc2)c(C2CNC2)cc1O	C19H23NO2	unknown
+COc1cc(CC(C)C)cc(OC)c1C1CNC1	C15H23NO2	unknown
+COc1cc(C2CNC2)c(OCc2ccccc2)cc1CC(C)C	C21H27NO2	unknown
+CNC(C)Cc1c[nH]c2ccc(F)cc12	C12H15FN2	tryptamine
+CNCC(=O)c1c[nH]c2ccc(F)cc12	C11H11FN2O	unknown
+CCC(N)C(=O)c1c[nH]c2ccc(F)cc12	C12H13FN2O	unknown
+Cc1nc2ccccn2c(=O)c1CCN1CCC(C(=O)c2ccc(F)cc2)CC1	C23H24FN3O2	unknown
+CC(O)C(C)OC(=O)[C@@H]1C[C@@H]2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C20H26N2O3	unknown
+CC(O)C(C)OC(=O)[C@@H]1C[C@@H]2c3cccc4c3c(cn4C)C[C@H]2N(C)C1	C21H28N2O3	unknown
+CCS(=O)c1cc(OC)c(CCN)cc1OC	C12H19NO3S	unknown
+CCS(=O)(=O)c1cc(OC)c(CCN)cc1OC	C12H19NO4S	unknown
+CCS(=O)c1cc(OC)c(CCNC(C)=O)cc1OC	C14H21NO4S	unknown
+CCS(=O)(=O)c1cc(OC)c(CCNC(C)=O)cc1OC	C14H21NO5S	unknown
+COc1cc(S(=O)C(C)C)c(OC)cc1CCN	C13H21NO3S	unknown
+COc1cc(S(=O)(=O)C(C)C)c(OC)cc1CCN	C13H21NO4S	unknown
+COc1cc(S(=O)C(C)C)c(OC)cc1CCNC(C)=O	C15H23NO4S	unknown
+COc1cc(S(=O)(=O)C(C)C)c(OC)cc1CCNC(C)=O	C15H23NO5S	unknown
+COc1cc(S(=O)CCO)c(OC)cc1CCN	C12H19NO4S	unknown
+COc1cc(S(=O)(=O)CCO)c(OC)cc1CCN	C12H19NO5S	unknown
+COc1cc(S(=O)CCO)c(OC)cc1CCNC(C)=O	C14H21NO5S	unknown
+COc1cc(S(=O)(=O)CCO)c(OC)cc1CCNC(C)=O	C14H21NO6S	unknown
+COc1cc(SC(C)CO)c(OC)cc1CCN	C13H21NO3S	unknown
+COc1cc(S(=O)C(C)CO)c(OC)cc1CCN	C13H21NO4S	unknown
+COc1cc(S(=O)(=O)C(C)CO)c(OC)cc1CCN	C13H21NO5S	unknown
+COc1cc(S(=O)C(C)CO)c(OC)cc1CCNC(C)=O	C15H23NO5S	unknown
+COc1cc(S(=O)(=O)C(C)CO)c(OC)cc1CCNC(C)=O	C15H23NO6S	unknown
+COc1cc(S(C)=O)c(OC)cc1CCN	C11H17NO3S	unknown
+COc1cc(S(C)(=O)=O)c(OC)cc1CCN	C11H17NO4S	unknown
+COc1cc(S(C)=O)c(OC)cc1CCNC(C)=O	C13H19NO4S	unknown
+COc1cc(S(C)(=O)=O)c(OC)cc1CCNC(C)=O	C13H19NO5S	unknown
+CCCS(=O)c1cc(OC)c(CCN)cc1OC	C13H21NO3S	unknown
+CCCS(=O)(=O)c1cc(OC)c(CCN)cc1OC	C13H21NO4S	unknown
+CCCS(=O)c1cc(OC)c(CCNC(C)=O)cc1OC	C15H23NO4S	unknown
+CCCS(=O)(=O)c1cc(OC)c(CCNC(C)=O)cc1OC	C15H23NO5S	unknown
+COc1cc(SCC(C)O)c(OC)cc1CCN	C13H21NO3S	unknown
+COc1cc(S(=O)CC(C)O)c(OC)cc1CCN	C13H21NO4S	unknown
+COc1cc(S(=O)(=O)CC(C)O)c(OC)cc1CCN	C13H21NO5S	unknown
+COc1cc(S(=O)CC(C)O)c(OC)cc1CCNC(C)=O	C15H23NO5S	unknown
+COc1cc(S(=O)(=O)CC(C)O)c(OC)cc1CCNC(C)=O	C15H23NO6S	unknown
+COc1cc(SCCCO)c(OC)cc1CCN	C13H21NO3S	unknown
+COc1cc(S(=O)CCCO)c(OC)cc1CCN	C13H21NO4S	unknown
+COc1cc(S(=O)(=O)CCCO)c(OC)cc1CCN	C13H21NO5S	unknown
+COc1cc(S(=O)CCCO)c(OC)cc1CCNC(C)=O	C15H23NO5S	unknown
+COc1cc(S(=O)(=O)CCCO)c(OC)cc1CCNC(C)=O	C15H23NO6S	unknown
+O=S(CCN1CCN(CC(O)Cc2ccccc2)CC1)C(c1ccc(F)cc1)c1ccc(F)cc1	C28H32F2N2O2S	unknown
+CCN(CC)c1ccc(/C=N/NC(=N)N)cc1	C12H19N5	unknown
+CC(=O)OC(C)=O	C4H6O3	unknown
+COc1cc2cc[nH]c2cc1OC	C10H11NO2	unknown
+c1cc2c3c(ccc2[nH]1)OCO3	C9H7NO2	unknown
+c1cc2cc3c(cc2[nH]1)OCO3	C9H7NO2	unknown
+Cc1cc2ccccc2[nH]1	C9H9N	unknown
+O=C(Cl)C(=O)Cl	C2Cl2O2	unknown
+COc1cc(SC)cc(OC)c1C=O	C10H12O3S	unknown
+COc1cc(SC)cc(OC)c1/C=C/[N+](=O)[O-]	C11H13NO4S	unknown
+CCSc1cc(OC)c(C=O)c(OC)c1	C11H14O3S	unknown
+CCSc1cc(OC)c(/C=C/[N+](=O)[O-])c(OC)c1	C12H15NO4S	unknown
+COc1cccc(C=O)c1O	C8H8O3	unknown
+COCn1cc(CCN(C)C)c2ccccc21	C14H20N2O	tryptamine
+COCn1c2c(c3ccccc31)CCN(C)C2	C14H18N2O	unknown
+CCOC(=O)NCCc1c[nH]c2ccccc12	C13H16N2O2	tryptamine
+CCOc1ccc(CC(C)=O)cc1	C11H14O2	unknown
+COc1ccc(OC)c(CCN2C(=O)c3ccccc3C2=O)c1	C18H17NO4	unknown
+COc1cc(OC(F)(F)F)c(OC)cc1CCN1C(=O)c2ccccc2C1=O	C19H16F3NO5	unknown
+COC(=O)c1nccc2c1[nH]c1cc(OC)ccc12	C14H12N2O3	unknown
+COc1ccc2c(c1)[nH]c1c(C(N)=O)nccc12	C13H11N3O2	unknown
+COc1ccc2c(c1)[nH]c1c(C(C)=O)nccc12	C14H12N2O2	unknown
+COc1ccc2c(c1)[nH]c1c(C)[n+]([O-])ccc12	C13H12N2O2	unknown
+COc1ccc2c3c([nH]c2c1)C(C(=O)O)=NCC3	C13H12N2O3	unknown
+COc1ccc2c3c([nH]c2c1)C(=O)NCC3	C12H12N2O2	unknown
+CC(N)Cc1ccc2c(c1)SC(F)(F)S2	C10H11F2NS2	prophetic
+CC1NC(C)(C)COC1(O)c1ccc(-c2ccccc2)cc1	C19H23NO2	unknown
+CC1NC(C)(C)COC1(O)c1ccc(Cl)c(Cl)c1	C13H17Cl2NO2	unknown
+CC1NC(C)(C)COC1(O)c1cccc(Br)c1	C13H18BrNO2	unknown
+CCC1NC(C)(C)COC1(O)c1cccc(Cl)c1	C14H20ClNO2	unknown
+CCCC1NC(C)(C)COC1(O)c1cccc(Cl)c1	C15H22ClNO2	unknown
+CC1NC(C)(C)COC1(O)c1ccc(Cl)cc1	C13H18ClNO2	unknown
+Cc1ccc(C2(O)OCC(C)(C)NC2C)cc1	C14H21NO2	unknown
+Cc1cccc(C2(O)OCC(C)(C)NC2C)c1	C14H21NO2	unknown
+CC1NC(C)(C)COC1(O)c1cccc(F)c1	C13H18FNO2	unknown
+CC(C(=O)c1ccccc1)N(C)Cc1ccccc1	C17H19NO	beta-ketone
+CNC(C)C(=O)c1ccccc1OC(F)(F)F	C11H12F3NO2	beta-ketone
+CNC(C)C(=O)c1cccc(OC(F)(F)F)c1	C11H12F3NO2	beta-ketone
+CNC(C)C(=O)c1cccc([N+](=O)[O-])c1	C10H12N2O3	beta-ketone
+CNC(C)C(=O)c1ccc(OC(F)(F)F)cc1	C11H12F3NO2	beta-ketone
+CNC(C)C(=O)c1c[nH]c2ccccc12	C12H14N2O	unknown
+CNC(C)C(=O)c1ccc(F)c(F)c1	C10H11F2NO	beta-ketone
+CNC(C)C(=O)c1ccc(C)c(Cl)c1	C11H14ClNO	beta-ketone
+NCCc1c[nH]c2cccc(F)c12	C10H11FN2	tryptamine
+Cc1ccc2c(CCN)c[nH]c2c1	C11H14N2	tryptamine
+CCC(N)Cc1c[nH]c2ccc(Cl)cc12	C12H15ClN2	tryptamine
+CC(NC1CC1)C(=O)c1cccc(Br)c1	C12H14BrNO	beta-ketone
+Cc1cccc(C(=O)C(C)NC2CC2)c1	C13H17NO	beta-ketone
+COc1cccc(C(=O)C(C)NC2CC2)c1	C13H17NO2	beta-ketone
+CC(NC1CC1)C(=O)c1ccc(Cl)cc1	C12H14ClNO	beta-ketone
+Cc1ccc(C(=O)C(C)NC2CC2)cc1	C13H17NO	beta-ketone
+CC(NC1CC1)C(=O)c1ccc(Cl)c(Cl)c1	C12H13Cl2NO	beta-ketone
+Cc1ccc(C(=O)C(C)NC2CC2)cc1Cl	C13H16ClNO	beta-ketone
+CCCc1cc(O)c2c(c1)OC(C)(C)[C@@H]1CC=C(C)C[C@@H]21	C19H26O2	cannabinoid
+CCCc1cc(O)c2c(c1)O[C@]1(C)CCC(=C(C)C)[C@H]2C1	C19H26O2	cannabinoid
+CCCCc1cc(O)c2c(c1)OC(C)(C)[C@@H]1CC=C(C)C[C@@H]21	C20H28O2	cannabinoid
+C=C1CC[C@@H]2[C@@H](C1)c1c(O)cc(CCCC)cc1OC2(C)C	C20H28O2	cannabinoid
+CCCCCCCCc1cc(O)c2c(c1)OC(C)(C)[C@@H]1CC=C(C)C[C@@H]21	C24H36O2	cannabinoid
+COC(=O)[C@@H](NC(=O)c1c(Cl)n(CC2CCCCC2)c2ccccc12)C(C)(C)C	C23H31ClN2O3	cannabinoid
+COC(=O)[C@@H](NC(=O)c1cn(CC2CCCCC2)c2cccc(Cl)c12)C(C)(C)C	C23H31ClN2O3	cannabinoid
+COC(=O)[C@@H](NC(=O)c1cn(CC2CCCCC2)c2ccc(Cl)cc12)C(C)(C)C	C23H31ClN2O3	cannabinoid
+COC(=O)[C@@H](NC(=O)c1cn(CC2CCCCC2)c2cc(Cl)ccc12)C(C)(C)C	C23H31ClN2O3	cannabinoid
+COC(=O)[C@@H](NC(=O)c1cn(CC2CCCCC2)c2c(Cl)cccc12)C(C)(C)C	C23H31ClN2O3	cannabinoid
+CN(C(=O)/C=C/c1ccoc1)[C@H]1CC[C@@]2(O)[C@H]3Cc4ccc(O)c5c4[C@@]2(CCN3CC2CC2)[C@H]1O5	C28H32N2O5	unknown
+CN(C(=O)/C=C/c1ccco1)[C@H]1CC[C@@]2(O)[C@H]3Cc4ccc(O)c5c4[C@@]2(CCN3CC2CC2)[C@H]1O5	C28H32N2O5	unknown
+CN(C(=O)/C=C/c1ccco1)[C@@H]1CC[C@@]2(O)[C@H]3Cc4ccc(O)c5c4[C@@]2(CCN3CC2CC2)[C@H]1O5	C28H32N2O5	unknown
+CN(C)CCc1cn(C(=O)OC(C)(C)C)c2ccccc12	C17H24N2O2	tryptamine
+COc1c([C@H]2[C@H](C(=O)Nc3ccnc(C(N)=O)c3)O[C@@](C)(C(F)(F)F)[C@H]2C)ccc(F)c1F	C21H20F5N3O4	unknown
+COc1cccc(CNCCc2cccc(F)c2)c1	C16H18FNO	unknown
+COc1ccc2[nH]cc(CCNCc3ccccc3F)c2c1	C18H19FN2O	tryptamine
+CCCC(C)NCCc1c[nH]c2ccc(OC)cc12	C16H24N2O	tryptamine
+CCC(CC)NCCc1c[nH]c2ccc(OC)cc12	C16H24N2O	tryptamine
+COc1ccc2[nH]cc(CCN(O)C(C)C)c2c1	C14H20N2O2	tryptamine
+CCC1NCCc2c1[nH]c1ccc(OC)cc21	C14H18N2O	unknown
+C[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(=O)N(C)[C@@H](Cc1ccccc1)C(=O)NCCO	C26H35N5O6	unknown
+C#CCN(C)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C20H21N3O	unknown
+C#CCN(CC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C21H23N3O	unknown
+CCN(CC#N)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C20H22N4O	unknown
+CCN(CC(F)F)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C20H23F2N3O	unknown
+CN1C[C@H](C(=O)N(CC(F)F)CC(F)F)C=C2c3cccc4[nH]cc(c34)C[C@H]21	C20H21F4N3O	unknown
+CCN(OC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C19H23N3O2	unknown
+C#CC1CCN1C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C21H21N3O	unknown
+C=CN(CC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C20H23N3O	unknown
+CCN(C=C(F)F)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C20H21F2N3O	unknown
+CON(CCF)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1	C19H22FN3O2	unknown
+C=C(F)CN1C[C@H](C(=O)N(CC)CC)C=C2c3cccc4[nH]cc(c34)C[C@H]21	C22H26FN3O	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(CC2CC2(F)F)C1	C23H27F2N3O	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(CC#N)C1	C21H24N4O	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(CC(C)=O)C1	C22H27N3O2	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(Cc2ccccc2)C1	C26H29N3O	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C2CCC2)C1	C23H29N3O	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C2COC2)C1	C22H27N3O2	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(CC2COC2)C1	C23H29N3O2	unknown
+C#CCN(CC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(CCF)C1	C22H24FN3O	unknown
+C#CCN(CC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(CC(=C)F)C1	C23H24FN3O	unknown
+C#CCN(CC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(CC2CC2(F)F)C1	C24H25F2N3O	unknown
+COc1ccc2cccc(CCN(C)C)c2c1	C15H19NO	unknown
+CCN(CC)CCc1cccc2ccc(OC)cc12	C17H23NO	unknown
+CCCN(CCC)CCc1cccc2ccc(OC)cc12	C19H27NO	unknown
+COc1ccc2cccc(CCN(C(C)C)C(C)C)c2c1	C19H27NO	unknown
+CCN(C)CCc1cccc2ccc(OC)cc12	C16H21NO	unknown
+CCCN(C)CCc1cccc2ccc(OC)cc12	C17H23NO	unknown
+COc1ccc2cccc(CCN(C)C(C)C)c2c1	C17H23NO	unknown
+CC(C)N(C)CCc1cccc2ccc(O)cc12	C16H21NO	unknown
+COc1ccc2cccc(CCN(C)C3CC3)c2c1	C17H21NO	unknown
+CN(CCc1cccc2ccc(O)cc12)C1CC1	C16H19NO	unknown
+COc1cccc(CNCCc2cccc3ccc(OC)cc23)c1	C21H23NO2	unknown
+COc1ccc2cccc(CCNCc3cccc(F)c3)c2c1	C20H20FNO	unknown
+COc1ccc2cccc(CCNCc3cccc(C)c3)c2c1	C21H23NO	unknown
+COc1ccc2cccc(CCNCc3ccccc3)c2c1	C20H21NO	unknown
+COc1cccc2cccc(CCN(C)C)c12	C15H19NO	unknown
+CN(C)CCc1cccc2cccc(O)c12	C14H17NO	unknown
+CCN(CC)CCc1cccc2cccc(OC)c12	C17H23NO	unknown
+CCCN(CCC)CCc1cccc2cccc(OC)c12	C19H27NO	unknown
+COc1cccc2cccc(CCN(C(C)C)C(C)C)c12	C19H27NO	unknown
+CCN(C)CCc1cccc2cccc(OC)c12	C16H21NO	unknown
+CCN(C)CCc1cccc2cccc(O)c12	C15H19NO	unknown
+CCCN(C)CCc1cccc2cccc(O)c12	C16H21NO	unknown
+COc1cccc2cccc(CCN(C)C(C)C)c12	C17H23NO	unknown
+CC(C)N(C)CCc1cccc2cccc(O)c12	C16H21NO	unknown
+COc1cccc2cccc(CCN(C)C3CC3)c12	C17H21NO	unknown
+CN(CCc1cccc2cccc(O)c12)C1CC1	C16H19NO	unknown
+COc1ccc2cccc(CCN(C)C)c2n1	C14H18N2O	unknown
+COc1cnc2cccc(CCN(C)C)c2c1	C14H18N2O	unknown
+CN(C)CCc1cccc2ccc(Cl)cc12	C14H16ClN	unknown
+CCN(C)CCc1cccc2ccccc12	C15H19N	unknown
+CC(C)N(C)CCc1cccc2ccccc12	C16H21N	unknown
+CN(CCc1cccc2ccc(Cl)cc12)C1CC1	C16H18ClN	unknown
+Clc1ccc2cccc(CCNCc3ccccc3)c2c1	C19H18ClN	unknown
+NCCc1cccc2ccc(F)cc12	C12H12FN	unknown
+CN(C)CCc1cccc2ccc(F)cc12	C14H16FN	unknown
+CCN(C)CCc1cccc2ccc(F)cc12	C15H18FN	unknown
+CC(C)N(C)CCc1cccc2ccc(F)cc12	C16H20FN	unknown
+CN(CCc1cccc2ccc(F)cc12)C1CC1	C16H18FN	unknown
+Fc1ccc2cccc(CCNCc3ccccc3)c2c1	C19H18FN	unknown
+COc1cccc2c(CCN)cccc12	C13H15NO	unknown
+COc1cccc2c(CCN(C)C)cccc12	C15H19NO	unknown
+COc1cc(CCNCCCCCCOCCCCc2ccccc2)c(OC)cc1Br	C26H38BrNO3	unknown
+C=CCN1C[C@@H](C(=O)N(CC)CC)C=C2c3cccc4[nH]cc(c34)C[C@H]21	C22H27N3O	unknown
+C=CCN1C[C@H](C(=O)N(CC)CC)C=C2c3cccc4c3c(cn4C(C)=O)C[C@H]21	C24H29N3O2	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3c(O)ccc4[nH]cc(c34)C[C@H]2N(C)C1	C20H25N3O2	unknown
+CCN(CC)C(=O)[C@@H]1C=C2c3c(OC)ccc4[nH]cc(c34)C[C@H]2N(C)C1	C21H27N3O2	unknown
+CCN(CCC(=O)N(CC)CC)CCc1c[nH]c2ccc(OC)cc12	C20H31N3O2	tryptamine