| 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 |