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7-Methyl-2-phenyl-2H-[1,2,4]triazolo[4,3-a]pyridin-3-one

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

7-Methyl-2-phenyl-2H-[1,2,4]triazolo[4,3-a]pyridin-3-one
SpectraBase Compound ID INEU9bHAPzY
InChI InChI=1S/C13H11N3O/c1-10-7-8-15-12(9-10)14-16(13(15)17)11-5-3-2-4-6-11/h2-9H,1H3
InChIKey SPVCXYHFVCGFBR-UHFFFAOYSA-N
Mol Weight 225.25 g/mol
Molecular Formula C13H11N3O
Exact Mass 225.090212 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID EuschIXWWAn
Name 7-Methyl-2-phenyl-2H-[1,2,4]triazolo[4,3-A]pyridin-3-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 225.090211985 u
Formula C13H11N3O
InChI InChI=1S/C13H11N3O/c1-10-7-8-15-12(9-10)14-16(13(15)17)11-5-3-2-4-6-11/h2-9H,1H3
InChIKey SPVCXYHFVCGFBR-UHFFFAOYSA-N
Molecular Weight 225.251 g/mol
SMILES C=12C=C(C=CN2C(N(N1)C=1C=CC=CC1)=O)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.936213