| SpectraBase Spectrum ID |
4Rrzdh9O3u9 |
| Name |
2H-[1,2,3]Triazole-4-carboxylic acid, 5-amino-2-phenyl-, 4-cyanobenzyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
319.106924677 u |
| Formula |
C17H13N5O2 |
| InChI |
InChI=1S/C17H13N5O2/c18-10-12-6-8-13(9-7-12)11-24-17(23)15-16(19)21-22(20-15)14-4-2-1-3-5-14/h1-9H,11H2,(H2,19,21) |
| InChIKey |
QGAYTFSCIPJAQR-UHFFFAOYSA-N |
| Molecular Weight |
319.324 g/mol |
| SMILES |
C1=CC=CC(=C1)N1N=C(C(N)=N1)C(=O)OCC=1C=CC(C#N)=CC1 |
![2H-[1,2,3]Triazole-4-carboxylic acid, 5-amino-2-phenyl-, 4-cyanobenzyl ester](/api/spectrum/4Rrzdh9O3u9/structure.png?h=300&w=458 "2H-[1,2,3]Triazole-4-carboxylic acid, 5-amino-2-phenyl-, 4-cyanobenzyl ester")
