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6-(p-Fluorobenzyl)sulfanyl-9-methyl-9H-purine

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6-(p-Fluorobenzyl)sulfanyl-9-methyl-9H-purine
SpectraBase Compound ID LLxECd6Goq8
InChI InChI=1S/C13H11FN4S/c1-18-8-17-11-12(18)15-7-16-13(11)19-6-9-2-4-10(14)5-3-9/h2-5,7-8H,6H2,1H3
InChIKey KYWALZXUABJANA-UHFFFAOYSA-N
Mol Weight 274.32 g/mol
Molecular Formula C13H11FN4S
Exact Mass 274.068846 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4bJBBeFxg0
Name 6-(p-Fluorobenzyl)sulfanyl-9-methyl-9H-purine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H11FN4S
InChI InChI=1S/C13H11FN4S/c1-18-8-17-11-12(18)15-7-16-13(11)19-6-9-2-4-10(14)5-3-9/h2-5,7-8H,6H2,1H3
InChIKey KYWALZXUABJANA-UHFFFAOYSA-N
Molecular Weight 274.317 g/mol
SMILES c12nc[n](c2ncnc1SCc1ccc(cc1)F)C
SPLASH splash10-05fu-0690000000-bb4436d3ceb4564839f7
Source of Spectrum AF-48-718-16
Synonyms 6-[(4-fluorophenyl)methylthio]-9-methylpurine 6-[(4-fluorophenyl)methylsulfanyl]-9-methylpurine 6-[(4-fluorophenyl)methylsulfanyl]-9-methyl-purine
Wiley ID 1693853