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9H-Purine-8-carbonitrile, 6-amino-3-methylthio-
SpectraBase Compound ID H0GVnGCNzLe
InChI InChI=1S/C7H6N6S/c1-14-7-12-5(9)4-6(13-7)11-3(2-8)10-4/h1H3,(H3,9,10,11,12,13)
InChIKey YQBAEALPIIXCBV-UHFFFAOYSA-N
Mol Weight 206.23 g/mol
Molecular Formula C7H6N6S
Exact Mass 206.037465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L8gTNoClf9G
Name 9H-Purine-8-carbonitrile, 6-amino-3-methylthio-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H6N6S
InChI InChI=1S/C7H6N6S/c1-14-7-12-5(9)4-6(13-7)11-3(2-8)10-4/h1H3,(H3,9,10,11,12,13)
InChIKey YQBAEALPIIXCBV-UHFFFAOYSA-N
Molecular Weight 206.227 g/mol
SMILES [nH]1c(nc2c(nc(nc12)SC)N)C#N
SPLASH splash10-0006-5900000000-2c9cb9f66cdfc22d188c
Synonyms 6-Amino-2-(methylsulfanyl)-9H-purine-8-carbonitrile 6-Amino-2-(methylthio)-7H-purine-8-carbonitrile 6-Amino-2-methylsulfanyl-7H-purine-8-carbonitrile 6-Azanyl-2-methylsulfanyl-7H-purine-8-carbonitrile
Wiley ID 1457272