Organoheterocyclic compounds

Organic compounds that consist of ring structures, or cyclic compounds that have atoms of at least two different elements as members of its ring(s).

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1-Methyl-2-pyrrolidone 99.0+%, TCI America™

CAS: 872-50-4 Molecular Formula: C5H9NO Molecular Weight (g/mol): 99.133 MDL Number: MFCD00003193 InChI Key: SECXISVLQFMRJM-UHFFFAOYSA-N Synonym: 1-methyl-2-pyrrolidinone,n-methyl-2-pyrrolidone,n-methylpyrrolidone,1-methyl-2-pyrrolidone,methylpyrrolidone,m-pyrol,n-methyl-2-pyrrolidinone,n-methylpyrrolidinone,1-methylpyrrolidinone,2-pyrrolidinone, 1-methyl PubChem CID: 13387 ChEBI: CHEBI:7307 IUPAC Name: 1-methylpyrrolidin-2-one SMILES: CN1CCCC1=O

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PubChem CID	13387
CAS	872-50-4
Molecular Weight (g/mol)	99.133
ChEBI	CHEBI:7307
MDL Number	MFCD00003193
SMILES	CN1CCCC1=O
Synonym	1-methyl-2-pyrrolidinone,n-methyl-2-pyrrolidone,n-methylpyrrolidone,1-methyl-2-pyrrolidone,methylpyrrolidone,m-pyrol,n-methyl-2-pyrrolidinone,n-methylpyrrolidinone,1-methylpyrrolidinone,2-pyrrolidinone, 1-methyl
IUPAC Name	1-methylpyrrolidin-2-one
InChI Key	SECXISVLQFMRJM-UHFFFAOYSA-N
Molecular Formula	C5H9NO

2-(1-Piperazinyl)pyrimidine, 98+%

CAS: 20980-22-7 Molecular Formula: C₈H₁₂N₄ Molecular Weight (g/mol): 164.21 MDL Number: MFCD00040742 InChI Key: MRBFGEHILMYPTF-UHFFFAOYSA-N Synonym: 2-1-piperazinyl pyrimidine,1-2-pyrimidyl piperazine,2-piperazin-1-yl pyrimidine,1-2-pyrimidinyl piperazine,2-piperazinopyrimidine,campiron,pyrimidine, 2-1-piperazinyl,campirone,kampirone,2-piperazin-1-yl-pyrimidine PubChem CID: 88747 IUPAC Name: 2-piperazin-1-ylpyrimidine SMILES: C1CN(CCN1)C2=NC=CC=N2

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Specifications

PubChem CID	88747
CAS	20980-22-7
Molecular Weight (g/mol)	164.21
MDL Number	MFCD00040742
SMILES	C1CN(CCN1)C2=NC=CC=N2
Synonym	2-1-piperazinyl pyrimidine,1-2-pyrimidyl piperazine,2-piperazin-1-yl pyrimidine,1-2-pyrimidinyl piperazine,2-piperazinopyrimidine,campiron,pyrimidine, 2-1-piperazinyl,campirone,kampirone,2-piperazin-1-yl-pyrimidine
IUPAC Name	2-piperazin-1-ylpyrimidine
InChI Key	MRBFGEHILMYPTF-UHFFFAOYSA-N
Molecular Formula	C₈H₁₂N₄

1-Methylimidazole 99.0+%, TCI America™

CAS: 616-47-7 Molecular Formula: C4H6N2 Molecular Weight (g/mol): 82.11 MDL Number: MFCD00005292 InChI Key: MCTWTZJPVLRJOU-UHFFFAOYSA-N Synonym: 1-methyl-1h-imidazole,n-methylimidazole,1h-imidazole, 1-methyl,imidazole, 1-methyl,n-methyl imidazole,1-methyl-imidazole,unii-p4617qs63y,1-methyl-1h-imidazol,n-methylimidazol,1-methylimdazole PubChem CID: 1390 ChEBI: CHEBI:113454 IUPAC Name: 1-methyl-1H-imidazole SMILES: CN1C=CN=C1

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Specifications

PubChem CID	1390
CAS	616-47-7
Molecular Weight (g/mol)	82.11
ChEBI	CHEBI:113454
MDL Number	MFCD00005292
SMILES	CN1C=CN=C1
Synonym	1-methyl-1h-imidazole,n-methylimidazole,1h-imidazole, 1-methyl,imidazole, 1-methyl,n-methyl imidazole,1-methyl-imidazole,unii-p4617qs63y,1-methyl-1h-imidazol,n-methylimidazol,1-methylimdazole
IUPAC Name	1-methyl-1H-imidazole
InChI Key	MCTWTZJPVLRJOU-UHFFFAOYSA-N
Molecular Formula	C4H6N2

PubChem CID	1390
CAS	616-47-7
Molecular Weight (g/mol)	82.11
ChEBI	CHEBI:113454
MDL Number	MFCD00005292
SMILES	CN1C=CN=C1
Synonym	1-methyl-1h-imidazole,n-methylimidazole,1h-imidazole, 1-methyl,imidazole, 1-methyl,n-methyl imidazole,1-methyl-imidazole,unii-p4617qs63y,1-methyl-1h-imidazol,n-methylimidazol,1-methylimdazole
IUPAC Name	1-methylimidazole
InChI Key	MCTWTZJPVLRJOU-UHFFFAOYSA-N
Molecular Formula	C4H6N2

1-(1-Naphthylmethyl)piperazine, 97%

CAS: 40675-81-8 Molecular Formula: C15H18N2 Molecular Weight (g/mol): 226.323 MDL Number: MFCD01314185 InChI Key: HGYDREHWXXUUIS-UHFFFAOYSA-N Synonym: 1-1-naphthylmethyl piperazine,1-naphthalen-1-ylmethyl piperazine,1-1-naphthylmethyl-piperazine,1-naphthalen-1-ylmethyl-piperazine,1-naphthalen-1-yl methyl piperazine,naphthylmethyl piperazine,1-naphthylmethyl piperazine,1-piperazin-1-yl naphthalene,1-naphth-1-ylmethyl piperazine,1-1-naphthalenylmethyl piperazine PubChem CID: 701891 IUPAC Name: 1-(naphthalen-1-ylmethyl)piperazine SMILES: C1CN(CCN1)CC2=CC=CC3=CC=CC=C32

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Specifications

PubChem CID	701891
CAS	40675-81-8
Molecular Weight (g/mol)	226.323
MDL Number	MFCD01314185
SMILES	C1CN(CCN1)CC2=CC=CC3=CC=CC=C32
Synonym	1-1-naphthylmethyl piperazine,1-naphthalen-1-ylmethyl piperazine,1-1-naphthylmethyl-piperazine,1-naphthalen-1-ylmethyl-piperazine,1-naphthalen-1-yl methyl piperazine,naphthylmethyl piperazine,1-naphthylmethyl piperazine,1-piperazin-1-yl naphthalene,1-naphth-1-ylmethyl piperazine,1-1-naphthalenylmethyl piperazine
IUPAC Name	1-(naphthalen-1-ylmethyl)piperazine
InChI Key	HGYDREHWXXUUIS-UHFFFAOYSA-N
Molecular Formula	C15H18N2

4-(1-Pyrrolidinyl)-1-butylamine, 98%

CAS: 24715-90-0 Molecular Formula: C8H18N2 Molecular Weight (g/mol): 142.25 MDL Number: MFCD00192591 InChI Key: LSDYCEIPEBJKPT-UHFFFAOYSA-N Synonym: 4-pyrrolidin-1-yl butan-1-amine,4-1-pyrrolidinyl-1-butanamine,1-pyrrolidinebutanamine,4-1-pyrrolidino butylamine,4-pyrrolidinobutylamine,4-1-pyrrolidinyl-1-butylamine,1-4-aminobutyl pyrrolidine,4-pyrrolidin-1-yl-butylamine,4-pyrrolidinylbutylamine,1-pyrrolidinebutylamine PubChem CID: 2762762 IUPAC Name: 4-pyrrolidin-1-ylbutan-1-amine SMILES: NCCCCN1CCCC1

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Specifications

PubChem CID	2762762
CAS	24715-90-0
Molecular Weight (g/mol)	142.25
MDL Number	MFCD00192591
SMILES	NCCCCN1CCCC1
Synonym	4-pyrrolidin-1-yl butan-1-amine,4-1-pyrrolidinyl-1-butanamine,1-pyrrolidinebutanamine,4-1-pyrrolidino butylamine,4-pyrrolidinobutylamine,4-1-pyrrolidinyl-1-butylamine,1-4-aminobutyl pyrrolidine,4-pyrrolidin-1-yl-butylamine,4-pyrrolidinylbutylamine,1-pyrrolidinebutylamine
IUPAC Name	4-pyrrolidin-1-ylbutan-1-amine
InChI Key	LSDYCEIPEBJKPT-UHFFFAOYSA-N
Molecular Formula	C8H18N2

1-Amino-1-cyclopropanecarboxylic acid, 99%

CAS: 22059-21-8 Molecular Formula: C4H7NO2 Molecular Weight (g/mol): 101.11 MDL Number: MFCD00009944 InChI Key: PAJPWUMXBYXFCZ-UHFFFAOYSA-N Synonym: 1-aminocyclopropanecarboxylic acid,1-amino-1-cyclopropanecarboxylic acid,cyclopropanecarboxylic acid, 1-amino,carboxycyclopropylamine,acc,alpha-aminocyclopropanecarboxylic acid,alpha-aminocyclopropane carboxylic acid,1-amino-cyclopropanecarboxylic acid,h-acpc-oh,aminocyclopropanecarboxylic acid PubChem CID: 535 ChEBI: CHEBI:18053 IUPAC Name: 1-aminocyclopropane-1-carboxylic acid SMILES: NC1(CC1)C(O)=O

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Specifications

PubChem CID	535
CAS	22059-21-8
Molecular Weight (g/mol)	101.11
ChEBI	CHEBI:18053
MDL Number	MFCD00009944
SMILES	NC1(CC1)C(O)=O
Synonym	1-aminocyclopropanecarboxylic acid,1-amino-1-cyclopropanecarboxylic acid,cyclopropanecarboxylic acid, 1-amino,carboxycyclopropylamine,acc,alpha-aminocyclopropanecarboxylic acid,alpha-aminocyclopropane carboxylic acid,1-amino-cyclopropanecarboxylic acid,h-acpc-oh,aminocyclopropanecarboxylic acid
IUPAC Name	1-aminocyclopropane-1-carboxylic acid
InChI Key	PAJPWUMXBYXFCZ-UHFFFAOYSA-N
Molecular Formula	C4H7NO2

1-Ethyl-1-methylpyrrolidinium bromide, 98%

CAS: 69227-51-6 Molecular Formula: C7H16BrN Molecular Weight (g/mol): 194.116 MDL Number: MFCD03095384 InChI Key: KHJQQUGSPDBDRM-UHFFFAOYSA-M Synonym: 1-ethyl-1-methylpyrrolidinium bromide,1-ethyl-1-methylpyrrolidin-1-ium bromide,1-ethyl-1-methylpyrrolidiniumbromide,pyrrolidinium, 1-ethyl-1-methyl-, bromide,1-methyl-1-ethylpyrrolidinium bromide,pyrrolidinium, 1-ethyl-1-methyl-, bromide 1:1,dsstox_cid_29306,dsstox_rid_83422,dsstox_gsid_49347,ksc495s4d PubChem CID: 112264 IUPAC Name: 1-ethyl-1-methylpyrrolidin-1-ium;bromide SMILES: CC[N+]1(CCCC1)C.[Br-]

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Specifications

PubChem CID	112264
CAS	69227-51-6
Molecular Weight (g/mol)	194.116
MDL Number	MFCD03095384
SMILES	CC[N+]1(CCCC1)C.[Br-]
Synonym	1-ethyl-1-methylpyrrolidinium bromide,1-ethyl-1-methylpyrrolidin-1-ium bromide,1-ethyl-1-methylpyrrolidiniumbromide,pyrrolidinium, 1-ethyl-1-methyl-, bromide,1-methyl-1-ethylpyrrolidinium bromide,pyrrolidinium, 1-ethyl-1-methyl-, bromide 1:1,dsstox_cid_29306,dsstox_rid_83422,dsstox_gsid_49347,ksc495s4d
IUPAC Name	1-ethyl-1-methylpyrrolidin-1-ium;bromide
InChI Key	KHJQQUGSPDBDRM-UHFFFAOYSA-M
Molecular Formula	C7H16BrN

3-(1-Pyridinio)-1-propanesulfonate, 99%

CAS: 15471-17-7 Molecular Formula: C8H11NO3S Molecular Weight (g/mol): 201.24 MDL Number: MFCD00064468 InChI Key: REEBJQTUIJTGAL-UHFFFAOYSA-N Synonym: 3-pyridin-1-ium-1-yl propane-1-sulfonate,ndsb-201,1-3-sulphonatopropyl pyridinium,unii-qn4i6ai9ek,3-1-pyridinio-1-propanesulfonate,1-pyridiniumpropane-3-sulfonate,qn4i6ai9ek,1-3-sulfopropyl pyridinium hydroxide, inner salt,pyridinium, 1-3-sulfopropyl-, inner salt,1-3-sulfonatopropyl pyridin-1-ium PubChem CID: 84929 IUPAC Name: 3-pyridin-1-ium-1-ylpropane-1-sulfonate SMILES: [O-]S(=O)(=O)CCC[N+]1=CC=CC=C1

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Specifications

PubChem CID	84929
CAS	15471-17-7
Molecular Weight (g/mol)	201.24
MDL Number	MFCD00064468
SMILES	[O-]S(=O)(=O)CCC[N+]1=CC=CC=C1
Synonym	3-pyridin-1-ium-1-yl propane-1-sulfonate,ndsb-201,1-3-sulphonatopropyl pyridinium,unii-qn4i6ai9ek,3-1-pyridinio-1-propanesulfonate,1-pyridiniumpropane-3-sulfonate,qn4i6ai9ek,1-3-sulfopropyl pyridinium hydroxide, inner salt,pyridinium, 1-3-sulfopropyl-, inner salt,1-3-sulfonatopropyl pyridin-1-ium
IUPAC Name	3-pyridin-1-ium-1-ylpropane-1-sulfonate
InChI Key	REEBJQTUIJTGAL-UHFFFAOYSA-N
Molecular Formula	C8H11NO3S

1-Methylimidazole, 99%

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Specifications

PubChem CID	1390
CAS	616-47-7
Molecular Weight (g/mol)	82.11
ChEBI	CHEBI:113454
MDL Number	MFCD00005292
SMILES	CN1C=CN=C1
Synonym	1-methyl-1h-imidazole,n-methylimidazole,1h-imidazole, 1-methyl,imidazole, 1-methyl,n-methyl imidazole,1-methyl-imidazole,unii-p4617qs63y,1-methyl-1h-imidazol,n-methylimidazol,1-methylimdazole
InChI Key	MCTWTZJPVLRJOU-UHFFFAOYSA-N
Molecular Formula	C4H6N2

1-Vinylimidazole, 99%

CAS: 1072-63-5 Molecular Formula: C5H6N2 Molecular Weight (g/mol): 94.12 MDL Number: MFCD00005297 InChI Key: OSSNTDFYBPYIEC-UHFFFAOYSA-N Synonym: 1-vinylimidazole,1-vinyl-1h-imidazole,n-vinylimidazole,1h-imidazole, 1-ethenyl,lufixan,polyvinylimidazole,poly vinylimidazole,poly n-vinylimidazole,poly 1-vinylimidazole,n-vinylimidazole polymer PubChem CID: 66171 SMILES: C=CN1C=CN=C1

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Specifications

PubChem CID	66171
CAS	1072-63-5
Molecular Weight (g/mol)	94.12
MDL Number	MFCD00005297
SMILES	C=CN1C=CN=C1
Synonym	1-vinylimidazole,1-vinyl-1h-imidazole,n-vinylimidazole,1h-imidazole, 1-ethenyl,lufixan,polyvinylimidazole,poly vinylimidazole,poly n-vinylimidazole,poly 1-vinylimidazole,n-vinylimidazole polymer
InChI Key	OSSNTDFYBPYIEC-UHFFFAOYSA-N
Molecular Formula	C5H6N2

1-(1-Methyl-4-piperidinyl)piperazine, 98%

CAS: 23995-88-2 Molecular Formula: C10H21N3 Molecular Weight (g/mol): 183.299 MDL Number: MFCD01075186 InChI Key: OHUMKYGINIODOY-UHFFFAOYSA-N Synonym: 1-1-methyl-4-piperidinyl piperazine,1-1-methylpiperidin-4-yl piperazine,1-n-methylpiperidin-4-yl piperazine,1-1-methyl-piperidin-4-yl-piperazine,piperazine, 1-1-methyl-4-piperidinyl,1-1-methyl-4-piperidyl piperazine,1-1-methyl-4-piperidino piperazine,zlchem 509,acmc-1cq7x,1-methyl-4-piperidyl piperazine PubChem CID: 566324 IUPAC Name: 1-(1-methylpiperidin-4-yl)piperazine SMILES: CN1CCC(CC1)N2CCNCC2

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Specifications

PubChem CID	566324
CAS	23995-88-2
Molecular Weight (g/mol)	183.299
MDL Number	MFCD01075186
SMILES	CN1CCC(CC1)N2CCNCC2
Synonym	1-1-methyl-4-piperidinyl piperazine,1-1-methylpiperidin-4-yl piperazine,1-n-methylpiperidin-4-yl piperazine,1-1-methyl-piperidin-4-yl-piperazine,piperazine, 1-1-methyl-4-piperidinyl,1-1-methyl-4-piperidyl piperazine,1-1-methyl-4-piperidino piperazine,zlchem 509,acmc-1cq7x,1-methyl-4-piperidyl piperazine
IUPAC Name	1-(1-methylpiperidin-4-yl)piperazine
InChI Key	OHUMKYGINIODOY-UHFFFAOYSA-N
Molecular Formula	C10H21N3

1-Benzylimidazole, 99%

CAS: 4238-71-5 Molecular Formula: C10H10N2 Molecular Weight (g/mol): 158.20 MDL Number: MFCD00005296 InChI Key: KKKDZZRICRFGSD-UHFFFAOYSA-N Synonym: 1-benzyl-1h-imidazole,n-benzylimidazole,imidazole, 1-benzyl,benzylimidazole,1h-imidazole, 1-phenylmethyl,1-benzyl imidazole,ccris 5821,chembl14192,1bn,1-benzylimdazole PubChem CID: 77918 IUPAC Name: 1-benzylimidazole SMILES: C(N1C=CN=C1)C1=CC=CC=C1

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Specifications

PubChem CID	77918
CAS	4238-71-5
Molecular Weight (g/mol)	158.20
MDL Number	MFCD00005296
SMILES	C(N1C=CN=C1)C1=CC=CC=C1
Synonym	1-benzyl-1h-imidazole,n-benzylimidazole,imidazole, 1-benzyl,benzylimidazole,1h-imidazole, 1-phenylmethyl,1-benzyl imidazole,ccris 5821,chembl14192,1bn,1-benzylimdazole
IUPAC Name	1-benzylimidazole
InChI Key	KKKDZZRICRFGSD-UHFFFAOYSA-N
Molecular Formula	C10H10N2

1H-Benzotriazol-1-yloxytri(1-pyrrolidinyl)phosphonium hexafluorophosphate, 98%

CAS: 128625-52-5 Molecular Formula: C18H28F6N6OP2 Molecular Weight (g/mol): 520.401 MDL Number: MFCD00077411 InChI Key: VIAFLMPQBHAMLI-UHFFFAOYSA-N Synonym: pybop,1h-benzo d 1,2,3 triazol-1-yl oxy tri pyrrolidin-1-yl phosphonium hexafluorophosphate v,benzotriazol-1-yloxy tripyrrolidinophosphonium hexafluorophosphate,benzotriazole-1-yl-oxytripyrrolidinophosphonium hexafluorophosphate,benzotriazol-1-yl-oxytripyrrolidinophosphonium hexafluorophosphate,1h-benzotriazol-1-yloxytripyrrolidinophosphonium hexafluorophosphate,benzotriazol-1-yloxytris pyrrolidino phosphonium hexafluorophosphate,benzotriazole-1-yl-oxy-tris-pyrrolidino-phosphonium hexafluorophosphate,benzotriazol-1-yl-oxy-tripyrrolidinophosphonium hexafluorophosphate,benzotriazol-1-yl-oxytripyrrolidinphosphonium hexafluorophosphate PubChem CID: 2724699 IUPAC Name: benzotriazol-1-yloxy(tripyrrolidin-1-yl)phosphanium;hexafluorophosphate SMILES: C1CCN(C1)[P+](N2CCCC2)(N3CCCC3)ON4C5=CC=CC=C5N=N4.F[P-](F)(F)(F)(F)F

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Specifications

PubChem CID	2724699
CAS	128625-52-5
Molecular Weight (g/mol)	520.401
MDL Number	MFCD00077411
SMILES	C1CCN(C1)[P+](N2CCCC2)(N3CCCC3)ON4C5=CC=CC=C5N=N4.F[P-](F)(F)(F)(F)F
Synonym	pybop,1h-benzo d 1,2,3 triazol-1-yl oxy tri pyrrolidin-1-yl phosphonium hexafluorophosphate v,benzotriazol-1-yloxy tripyrrolidinophosphonium hexafluorophosphate,benzotriazole-1-yl-oxytripyrrolidinophosphonium hexafluorophosphate,benzotriazol-1-yl-oxytripyrrolidinophosphonium hexafluorophosphate,1h-benzotriazol-1-yloxytripyrrolidinophosphonium hexafluorophosphate,benzotriazol-1-yloxytris pyrrolidino phosphonium hexafluorophosphate,benzotriazole-1-yl-oxy-tris-pyrrolidino-phosphonium hexafluorophosphate,benzotriazol-1-yl-oxy-tripyrrolidinophosphonium hexafluorophosphate,benzotriazol-1-yl-oxytripyrrolidinphosphonium hexafluorophosphate
IUPAC Name	benzotriazol-1-yloxy(tripyrrolidin-1-yl)phosphanium;hexafluorophosphate
InChI Key	VIAFLMPQBHAMLI-UHFFFAOYSA-N
Molecular Formula	C18H28F6N6OP2

1-Phenylpyrrole, 99%

CAS: 635-90-5 Molecular Formula: C10H9N Molecular Weight (g/mol): 143.19 MDL Number: MFCD00005343 InChI Key: GEZGAZKEOUKLBR-UHFFFAOYSA-N Synonym: 1-phenyl-1h-pyrrole,n-phenylpyrrole,pyrrole, 1-phenyl,1h-pyrrole, 1-phenyl,unii-3od6n6545h,chembl84459,1-phenylpyrrol,acmc-209ngl,1-phenylpyrrole,1-phenyl-1h-pyrrole # PubChem CID: 12480 IUPAC Name: 1-phenylpyrrole SMILES: C1=CN(C=C1)C1=CC=CC=C1

Pricing & Availability
Specifications

PubChem CID	12480
CAS	635-90-5
Molecular Weight (g/mol)	143.19
MDL Number	MFCD00005343
SMILES	C1=CN(C=C1)C1=CC=CC=C1
Synonym	1-phenyl-1h-pyrrole,n-phenylpyrrole,pyrrole, 1-phenyl,1h-pyrrole, 1-phenyl,unii-3od6n6545h,chembl84459,1-phenylpyrrol,acmc-209ngl,1-phenylpyrrole,1-phenyl-1h-pyrrole #
IUPAC Name	1-phenylpyrrole
InChI Key	GEZGAZKEOUKLBR-UHFFFAOYSA-N
Molecular Formula	C10H9N

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