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4-(3-Acetyl-6-oxo-5-phenyl-6H-[1,2,4]triazin-1-yl)benzonitrile

View entire compound with spectra: 1 FTIR, and 2 MS (GC)

4-(3-Acetyl-6-oxo-5-phenyl-6H-[1,2,4]triazin-1-yl)benzonitrile
SpectraBase Compound ID 2plMANbTAXh
InChI InChI=1S/C18H12N4O2/c1-12(23)17-20-16(14-5-3-2-4-6-14)18(24)22(21-17)15-9-7-13(11-19)8-10-15/h2-10H,1H3
InChIKey ZZDQQURQFSXFPM-UHFFFAOYSA-N
Mol Weight 316.32 g/mol
Molecular Formula C18H12N4O2
Exact Mass 316.096026 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2IhYN5OaBeM
Name 4-(3-ACETYL-6-OXO-5-PHENYL-6H-[1,2,4]TRIAZIN-1-YL)BENZONITRILE
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C18H12N4O2
InChI InChI=1S/C18H12N4O2/c1-12(23)17-20-16(14-5-3-2-4-6-14)18(24)22(21-17)15-9-7-13(11-19)8-10-15/h2-10H,1H3
InChIKey ZZDQQURQFSXFPM-UHFFFAOYSA-N
Molecular Weight 316.0958
SMILES C=1(c2ccccc2)C(=O)N(c2ccc(C#N)cc2)N=C(C(C)=O)N1
SPLASH splash10-0006-9300000000-7761ed3f322c4e532810
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany