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9-Methyl-6-chloro-8-[(p-methylthio)phenyl]-9H-purine
SpectraBase Compound ID 7mkwB7bzCXH
InChI InChI=1S/C13H11ClN4S/c1-18-12(8-3-5-9(19-2)6-4-8)17-10-11(14)15-7-16-13(10)18/h3-7H,1-2H3
InChIKey MEGTZGXCDXTEIP-UHFFFAOYSA-N
Mol Weight 290.77 g/mol
Molecular Formula C13H11ClN4S
Exact Mass 290.039295 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B5mxU8Sf49q
Name 9-Methyl-6-chloro-8-[(p-methylthio)phenyl]-9H-purine
Alternate Name(s) 6-Chloro-9-methyl-8-(4-methylsulfanylphenyl)purine 6-Chloranyl-9-methyl-8-(4-methylsulfanylphenyl)purine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H11ClN4S
InChI InChI=1S/C13H11ClN4S/c1-18-12(8-3-5-9(19-2)6-4-8)17-10-11(14)15-7-16-13(10)18/h3-7H,1-2H3
InChIKey MEGTZGXCDXTEIP-UHFFFAOYSA-N
Molecular Weight 290.772 g/mol
SMILES c1([n](c2c(n1)c(ncn2)Cl)C)-c1ccc(cc1)SC
SPLASH splash10-0006-0090000000-581a455da44ffefd0fc4
Source of Spectrum AF-48-720-46
Wiley ID 1713912