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9-(Phenylmethyl)-6-thiophen-2-yl-purine
SpectraBase Compound ID KHKGEoGFsmA
InChI InChI=1S/C16H12N4S/c1-2-5-12(6-3-1)9-20-11-19-15-14(13-7-4-8-21-13)17-10-18-16(15)20/h1-8,10-11H,9H2
InChIKey PAAXDEJAQCUKRO-UHFFFAOYSA-N
Mol Weight 292.36 g/mol
Molecular Formula C16H12N4S
Exact Mass 292.078268 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LYKVd922mCx
Name 9-(Phenylmethyl)-6-thiophen-2-yl-purine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12N4S
InChI InChI=1S/C16H12N4S/c1-2-5-12(6-3-1)9-20-11-19-15-14(13-7-4-8-21-13)17-10-18-16(15)20/h1-8,10-11H,9H2
InChIKey PAAXDEJAQCUKRO-UHFFFAOYSA-N
Molecular Weight 292.360 g/mol
SMILES c12c([n](Cc3ccccc3)cn1)ncnc2-c1sccc1
SPLASH splash10-0006-4090000000-127eb3af948b8b249703
Source of Spectrum F-50-9752-5
Synonyms 9-Benzyl-6-(2-thienyl)purine 9-Benzyl-6-(2-thienyl)-9H-purine 9-(Phenylmethyl)-6-thiophen-2-ylpurine 9-Benzyl-6-thiophen-2-ylpurine
Wiley ID 1295312