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6-Amino-9-(phenylmethyl)-7H-purin-8-one
SpectraBase Compound ID BPHYRWcJqtW
InChI InChI=1S/C12H11N5O/c13-10-9-11(15-7-14-10)17(12(18)16-9)6-8-4-2-1-3-5-8/h1-5,7H,6H2,(H,16,18)(H2,13,14,15)
InChIKey MCVICBSLLMHLBJ-UHFFFAOYSA-N
Mol Weight 241.25 g/mol
Molecular Formula C12H11N5O
Exact Mass 241.09636 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8RxgZvlLPCI
Name 6-Amino-9-(phenylmethyl)-7H-purin-8-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H11N5O
InChI InChI=1S/C12H11N5O/c13-10-9-11(15-7-14-10)17(12(18)16-9)6-8-4-2-1-3-5-8/h1-5,7H,6H2,(H,16,18)(H2,13,14,15)
InChIKey MCVICBSLLMHLBJ-UHFFFAOYSA-N
Molecular Weight 241.254 g/mol
SMILES Nc1ncnc2c1NC(N2Cc1ccccc1)=O
SPLASH splash10-0006-3190000000-95f41ea494ac640e5d71
Source of Spectrum H1-55-2282-3
Synonyms 6-Amino-9-benzyl-7H-purin-8-one 6-Azanyl-9-(phenylmethyl)-7H-purin-8-one
Wiley ID 1564691