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7-benzyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione
SpectraBase Compound ID 53jMMfRvRzh
InChI InChI=1S/C13H12N4O2/c1-16-11-10(12(18)15-13(16)19)17(8-14-11)7-9-5-3-2-4-6-9/h2-6,8H,7H2,1H3,(H,15,18,19)
InChIKey NGGPQVDOOZWSIG-UHFFFAOYSA-N
Mol Weight 256.26 g/mol
Molecular Formula C13H12N4O2
Exact Mass 256.096026 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BAlMrzJtFAr
Name 7-Benzyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12N4O2
InChI InChI=1S/C13H12N4O2/c1-16-11-10(12(18)15-13(16)19)17(8-14-11)7-9-5-3-2-4-6-9/h2-6,8H,7H2,1H3,(H,15,18,19)
InChIKey NGGPQVDOOZWSIG-UHFFFAOYSA-N
Molecular Weight 256.265 g/mol
SMILES N1C(c2c(N(C1=O)C)nc[n]2Cc1ccccc1)=O
SPLASH splash10-0006-9010000000-14e6637c785ff15e3c7c
Synonyms 3-Methyl-7-(phenylmethyl)purine-2,6-dione 7-Benzyl-3-methyl-purine-2,6-dione 7-Benzyl-3-methyl-xanthine Purine-2,6-dione, 7-benzyl-3-methyl-3,7-dihydro-
Wiley ID 1436370