| SpectraBase Spectrum ID |
KWqdPiefMca |
| Name |
3-Acetyl-5-(1-hydroxyethyl)-1-phenyl-4,5-dihydro-1H-[1,2,4]triazin-6-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
261.111341352 u |
| Formula |
C13H15N3O3 |
| InChI |
InChI=1S/C13H15N3O3/c1-8(17)11-13(19)16(10-6-4-3-5-7-10)15-12(14-11)9(2)18/h3-8,11,17H,1-2H3,(H,14,15) |
| InChIKey |
JUUJDBRVWFZFNR-UHFFFAOYSA-N |
| Molecular Weight |
261.281 g/mol |
| SMILES |
C1=CC=C(C=C1)N1N=C(C(C)=O)NC(C1=O)C(C)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.852593 |
![3-Acetyl-5-(1-hydroxyethyl)-1-phenyl-4,5-dihydro-1H-[1,2,4]triazin-6-one](/api/spectrum/KWqdPiefMca/structure.png?h=300&w=458 "3-Acetyl-5-(1-hydroxyethyl)-1-phenyl-4,5-dihydro-1H-[1,2,4]triazin-6-one")
