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6-(PARA-METHYL-PHENYL)-4(3H)-PTERIDINONE

View entire compound with spectra: 1 NMR, and 1 MS (GC)

6-(PARA-METHYL-PHENYL)-4(3H)-PTERIDINONE
SpectraBase Compound ID 2Oyh7S3RzJD
InChI InChI=1S/C13H10N4O/c1-8-2-4-9(5-3-8)10-6-14-12-11(17-10)13(18)16-7-15-12/h2-7H,1H3,(H,14,15,16,18)
InChIKey IEDJJYYKILERFQ-UHFFFAOYSA-N
Mol Weight 238.25 g/mol
Molecular Formula C13H10N4O
Exact Mass 238.085461 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7VjLOyhJgcg
Name 6-(4-Methylphenyl)-1H-pteridin-4-one
CAS Registry Number 81346-77-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H10N4O
InChI InChI=1S/C13H10N4O/c1-8-2-4-9(5-3-8)10-6-14-12-11(17-10)13(18)16-7-15-12/h2-7H,1H3,(H,14,15,16,18)
InChIKey IEDJJYYKILERFQ-UHFFFAOYSA-N
Molecular Weight 238.250 g/mol
SMILES N1C=NC(c2c1ncc(n2)-c1ccc(cc1)C)=O
SPLASH splash10-000i-0290000000-2e2a670fda285768c4b9
Source of Spectrum Y-24-449-1
Synonyms 6-(p-tolyl)-1H-pteridin-4-one
Wiley ID 1240412