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9-(p-Fluorobenzyl)-6-[phenylthio]-9H-purine
SpectraBase Compound ID Htb34lYL7TQ
InChI InChI=1S/C18H13FN4S/c19-14-8-6-13(7-9-14)10-23-12-22-16-17(23)20-11-21-18(16)24-15-4-2-1-3-5-15/h1-9,11-12H,10H2
InChIKey IHJWHIRJWNFCOO-UHFFFAOYSA-N
Mol Weight 336.39 g/mol
Molecular Formula C18H13FN4S
Exact Mass 336.084496 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HgbFaFWEc8R
Name 9-(p-Fluorobenzyl)-6-[phenylthio]-9H-purine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H13FN4S
InChI InChI=1S/C18H13FN4S/c19-14-8-6-13(7-9-14)10-23-12-22-16-17(23)20-11-21-18(16)24-15-4-2-1-3-5-15/h1-9,11-12H,10H2
InChIKey IHJWHIRJWNFCOO-UHFFFAOYSA-N
Molecular Weight 336.388 g/mol
SMILES c12c([n](Cc3ccc(cc3)F)cn1)ncnc2Sc1ccccc1
SPLASH splash10-0a4i-2913000000-e2d17620bf0c6706f116
Source of Spectrum AF-48-721-59
Synonyms 9-[(4-fluorophenyl)methyl]-6-(phenylthio)purine 9-[(4-fluorophenyl)methyl]-6-phenylsulfanylpurine 9-[(4-fluorophenyl)methyl]-6-phenylsulfanyl-purine
Wiley ID 1713907