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1-Butan-2-yl-2-methyl-7-phenyl-6-purinone
SpectraBase Compound ID 4qFqXQN46ZF
InChI InChI=1S/C16H18N4O/c1-4-11(2)20-12(3)18-15-14(16(20)21)19(10-17-15)13-8-6-5-7-9-13/h5-11H,4H2,1-3H3
InChIKey SRYGKRISUNDMOT-UHFFFAOYSA-N
Mol Weight 282.35 g/mol
Molecular Formula C16H18N4O
Exact Mass 282.148061 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FhC03m6fpj
Name 1-Butan-2-yl-2-methyl-7-phenyl-6-purinone
Alternate Name(s) 1-Butan-2-yl-2-methyl-7-phenyl-purin-6-one 2-Methyl-7-phenyl-1-sec-butyl-purin-6-one
CAS Registry Number 83325-08-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18N4O
InChI InChI=1S/C16H18N4O/c1-4-11(2)20-12(3)18-15-14(16(20)21)19(10-17-15)13-8-6-5-7-9-13/h5-11H,4H2,1-3H3
InChIKey SRYGKRISUNDMOT-UHFFFAOYSA-N
Molecular Weight 282.347 g/mol
SMILES C1(=O)c2c(N=C(N1C(CC)C)C)nc[n]2-c1ccccc1
SPLASH splash10-004i-0090000000-e8d2435bed1cedecc6ad
Source of Spectrum F-38-1439-0
Wiley ID 1285933