| SpectraBase Spectrum ID |
9ta6B0Cacru |
| Name |
6-Cyano-8-methoxycarbonyl-2-methyl-7-phenyl-3H-[1,2,4]triazolo[1,5-A]pyridin-5-one |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
308.090940259 u |
| Formula |
C16H12N4O3 |
| InChI |
InChI=1S/C16H12N4O3/c1-9-18-14-13(16(22)23-2)12(10-6-4-3-5-7-10)11(8-17)15(21)20(14)19-9/h3-7H,1-2H3,(H,18,19) |
| InChIKey |
ZKYRMDRJQOZFKU-UHFFFAOYSA-N |
| Molecular Weight |
308.297 g/mol |
| SMILES |
C12=C(C(=C(C(N2NC(=N1)C)=O)C#N)C=1C=CC=CC1)C(=O)OC |
![6-Cyano-8-methoxycarbonyl-2-methyl-7-phenyl-3H-[1,2,4]triazolo[1,5-a]pyridin-5-one](/api/spectrum/9ta6B0Cacru/structure.png?h=300&w=458 "6-Cyano-8-methoxycarbonyl-2-methyl-7-phenyl-3H-[1,2,4]triazolo[1,5-a]pyridin-5-one")
