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3-Methyl-2-(4-methylphenyl)-6-phenyl-1,2,4-triazin-5(2H)-one
SpectraBase Compound ID 6epILJbwN46
InChI InChI=1S/C17H15N3O/c1-12-8-10-15(11-9-12)20-13(2)18-17(21)16(19-20)14-6-4-3-5-7-14/h3-11H,1-2H3
InChIKey ZUFLSOOFQDGEAE-UHFFFAOYSA-N
Mol Weight 277.33 g/mol
Molecular Formula C17H15N3O
Exact Mass 277.121512 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID BK7vG6LhHyY
Name 3-Methyl-2-(4-methylphenyl)-6-phenyl-1,2,4-triazin-5(2H)-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 277.121512114 u
Formula C17H15N3O
InChI InChI=1S/C17H15N3O/c1-12-8-10-15(11-9-12)20-13(2)18-17(21)16(19-20)14-6-4-3-5-7-14/h3-11H,1-2H3
InChIKey ZUFLSOOFQDGEAE-UHFFFAOYSA-N
SMILES C1(=NN(C(=NC1=O)C)C=1C=CC(=CC1)C)C1=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.904596