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1H-Purin-2-amine, 6-(methylthio)-
SpectraBase Compound ID 9MG2nbSGpNv
InChI InChI=1S/C6H7N5S/c1-12-5-3-4(9-2-8-3)10-6(7)11-5/h2H,1H3,(H3,7,8,9,10,11)
InChIKey YEGKYFQLKYGHAR-UHFFFAOYSA-N
Mol Weight 181.22 g/mol
Molecular Formula C6H7N5S
Exact Mass 181.042216 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fa5W4F2AllW
Name 1H-Purin-2-amine, 6-(methylthio)-
CAS Registry Number 1198-47-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H7N5S
InChI InChI=1S/C6H7N5S/c1-12-5-3-4(9-2-8-3)10-6(7)11-5/h2H,1H3,(H3,7,8,9,10,11)
InChIKey YEGKYFQLKYGHAR-UHFFFAOYSA-N
Molecular Weight 181.217 g/mol
SMILES Nc1nc(c2nc[nH]c2n1)SC
SPLASH splash10-001i-8900000000-54e4bb43488c9844104a
Source of Spectrum W6-12518-0-0
Synonyms 6-(Methylsulfanyl)-1H-purin-2-amine 1H-purin-2-amine, 6-(methylthio)-, hemihydrate 2-Amino-6-methylmercaptopurine 2-Amino-6-methylthiopurine 6-(methylthio)-1H-purin-2-amine 6-(methylthio)-7H-purin-2-amine 6-Methylsulfanyl-7H-purin-2-amine 6-Methylthioguanine Purine, 2-amino-6-(methylthio)- [6-(methylthio)-7H-purin-2-yl]amine AI3-52059 EINECS 214-833-4 NSC 29420
Wiley ID 18363