| SpectraBase Spectrum ID |
B8SLtGpzYML |
| Name |
2-Phenyl-4-acetyl-3H-imidazo[1,5-B]pyridazine-5,7-(6H)-dione |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
269.080041223 u |
| Formula |
C14H11N3O3 |
| InChI |
InChI=1S/C14H11N3O3/c1-8(18)10-7-11(9-5-3-2-4-6-9)16-17-12(10)13(19)15-14(17)20/h2-6H,7H2,1H3,(H,15,19,20) |
| InChIKey |
DYNKAQJHWCATIG-UHFFFAOYSA-N |
| SMILES |
C1C(=NN2C(=C1C(=O)C)C(=O)NC2=O)C1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.972779 |
![2-Phenyl-4-acetyl-3H-imidazo[1,5-B]pyridazine-5,7-(6H)-dione](/api/spectrum/B8SLtGpzYML/structure.png?h=300&w=458 "2-Phenyl-4-acetyl-3H-imidazo[1,5-B]pyridazine-5,7-(6H)-dione")
