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3-Acetyl-1-(4-methylphenyl)-4,5-dihydro-1,2,4-triazin-6(1H)-one

View entire compound with spectra: 2 MS (GC)

3-Acetyl-1-(4-methylphenyl)-4,5-dihydro-1,2,4-triazin-6(1H)-one
SpectraBase Compound ID 6vst1mfFqk3
InChI InChI=1S/C12H13N3O2/c1-8-3-5-10(6-4-8)15-11(17)7-13-12(14-15)9(2)16/h3-6H,7H2,1-2H3,(H,13,14)
InChIKey DVIQLGWPAPWLDQ-UHFFFAOYSA-N
Mol Weight 231.25 g/mol
Molecular Formula C12H13N3O2
Exact Mass 231.100777 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9ViYd100FZN
Name 3-ACETYL-1-p-TOLYL-4,5-DIHYDRO-1H-[1,2,4]TRIAZIN-6-ONE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H13N3O2
InChI InChI=1S/C12H13N3O2/c1-8-3-5-10(6-4-8)15-11(17)7-13-12(14-15)9(2)16/h3-6H,7H2,1-2H3,(H,13,14)
InChIKey DVIQLGWPAPWLDQ-UHFFFAOYSA-N
Molecular Weight 231.1005
SMILES N1CC(N(N=C1C(C)=O)c1ccc(C)cc1)=O
SPLASH splash10-0uec-9460000000-e9d285f9d42e20c11509
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany