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2-[(6-Amino-9H-purin-8-yl)sulfanyl]ethanol
SpectraBase Compound ID FVsP8mQ4Jf0
InChI InChI=1S/C7H9N5OS/c8-5-4-6(10-3-9-5)12-7(11-4)14-2-1-13/h3,13H,1-2H2,(H3,8,9,10,11,12)
InChIKey FYLZGUONYMYQCE-UHFFFAOYSA-N
Mol Weight 211.24 g/mol
Molecular Formula C7H9N5OS
Exact Mass 211.052781 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6btQj7cNP2z
Name 2-[(6-Amino-9H-purin-8-yl)sulfanyl]ethanol
CAS Registry Number 57654-58-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H9N5OS
InChI InChI=1S/C7H9N5OS/c8-5-4-6(10-3-9-5)12-7(11-4)14-2-1-13/h3,13H,1-2H2,(H3,8,9,10,11,12)
InChIKey FYLZGUONYMYQCE-UHFFFAOYSA-N
Molecular Weight 211.243 g/mol
SMILES OCCSc1nc2c(ncnc2[nH]1)N
SPLASH splash10-014i-3910000000-7e0de043379f94c8bec7
Source of Spectrum AD-0-2532-0
Synonyms 2-[(6-amino-7H-purin-8-yl)sulfanyl]ethanol 2-[(6-amino-7H-purin-8-yl)thio]ethanol 2-[(6-azanyl-7H-purin-8-yl)sulfanyl]ethanol Ethanol, 2-(6-amino-1H-purin-8-ylthio)-
Wiley ID 1432941