| SpectraBase Spectrum ID |
Jp4sONnllE |
| Name |
3-Acetyl-1-(4-fluorophenyl)-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 |
235.075704735 u |
| Formula |
C11H10FN3O2 |
| InChI |
InChI=1S/C11H10FN3O2/c1-7(16)11-13-6-10(17)15(14-11)9-4-2-8(12)3-5-9/h2-5H,6H2,1H3,(H,13,14) |
| InChIKey |
MBLAGIPGKSTNFE-UHFFFAOYSA-N |
| Molecular Weight |
235.218 g/mol |
| SMILES |
C1(F)=CC=C(C=C1)N1N=C(C(C)=O)NCC1=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.87684 |
![3-Acetyl-1-(4-fluorophenyl)-4,5-dihydro-1H-[1,2,4]triazin-6-one](/api/spectrum/Jp4sONnllE/structure.png?h=300&w=458 "3-Acetyl-1-(4-fluorophenyl)-4,5-dihydro-1H-[1,2,4]triazin-6-one")
