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1H-Purine, 2-methyl-6-(methylthio)-
SpectraBase Compound ID tL0uw0yX3y
InChI InChI=1S/C7H8N4S/c1-4-10-6-5(8-3-9-6)7(11-4)12-2/h3H,1-2H3,(H,8,9,10,11)
InChIKey BXIODMKZAUYUKD-UHFFFAOYSA-N
Mol Weight 180.23 g/mol
Molecular Formula C7H8N4S
Exact Mass 180.046967 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I7cYoztKW2j
Name 1H-Purine, 2-methyl-6-(methylthio)-
Alternate Name(s) Methyl 2-methyl-1H-purin-6-yl sulfide 2-Methyl-6-(methylthio)-7H-purine 2-Methyl-6-methylthiopurine Purine, 2-methyl-6-(methylthio)-
CAS Registry Number 1008-47-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H8N4S
InChI InChI=1S/C7H8N4S/c1-4-10-6-5(8-3-9-6)7(11-4)12-2/h3H,1-2H3,(H,8,9,10,11)
InChIKey BXIODMKZAUYUKD-UHFFFAOYSA-N
Molecular Weight 180.229 g/mol
SMILES [nH]1c2c(nc1)nc(nc2SC)C
SPLASH splash10-001l-6900000000-f772463b571f89f2dcc2
Source of Spectrum O5-0-279-0
Wiley ID 17994