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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 6W2yzFkCOPO
Name 3-Acetyl-1-(4-methylphenyl)-4,5-dihydro-1,2,4-triazin-6(1H)-one
Alternate Name(s) 3-Acetyl-1-(4-methylphenyl)-2,5-dihydro-1,2,4-triazin-6-one 3-Acetyl-1-(p-tolyl)-2,5-dihydro-1,2,4-triazin-6-one 3-Acetyl-1-p-tolyl-4,5-dihydro-1H-[1,2,4]triazin-6-one 3-Ethanoyl-1-(4-methylphenyl)-2,5-dihydro-1,2,4-triazin-6-one
CAS Registry Number 173560-18-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. 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 231.255 g/mol
SMILES N1C(=NN(C(C1)=O)c1ccc(cc1)C)C(=O)C
SPLASH splash10-0uec-9460000000-45182ebbe8e42ea1e89f
Wiley ID 1475733