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1-(4-amino-6-methyl-2-phenyl-5-pyrimidinyl)ethanone
SpectraBase Compound ID JBCrYkPSHRL
InChI InChI=1S/C13H13N3O/c1-8-11(9(2)17)12(14)16-13(15-8)10-6-4-3-5-7-10/h3-7H,1-2H3,(H2,14,15,16)
InChIKey SSCOMJFZOSOOKU-UHFFFAOYSA-N
Mol Weight 227.27 g/mol
Molecular Formula C13H13N3O
Exact Mass 227.105862 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3SQw6YF3rn
Name 1-(4-amino-6-methyl-2-phenyl-5-pyrimidinyl)ethanone
Alternate Name(s) 1-(4-amino-6-methyl-2-phenyl-pyrimidin-5-yl)ethanone 1-(4-azanyl-6-methyl-2-phenyl-pyrimidin-5-yl)ethanone
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13N3O
InChI InChI=1S/C13H13N3O/c1-8-11(9(2)17)12(14)16-13(15-8)10-6-4-3-5-7-10/h3-7H,1-2H3,(H2,14,15,16)
InChIKey SSCOMJFZOSOOKU-UHFFFAOYSA-N
Molecular Weight 227.267 g/mol
SMILES Nc1nc(nc(C)c1C(=O)C)-c1ccccc1
SPLASH splash10-03fr-0090000000-a5da90dd6f22e7410081
Source of Spectrum F9-1990-146-0
Wiley ID 1566162