| SpectraBase Spectrum ID |
3PYkhNGtBuj |
| Name |
{[4-(p-Methoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]thio}acetic acid |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
341.083412526 u |
| Formula |
C17H15N3O3S |
| InChI |
InChI=1S/C17H15N3O3S/c1-23-14-9-7-13(8-10-14)20-16(12-5-3-2-4-6-12)18-19-17(20)24-11-15(21)22/h2-10H,11H2,1H3,(H,21,22) |
| InChIKey |
XDZODQKTJBWKOO-UHFFFAOYSA-N |
| Molecular Weight |
341.385 g/mol |
| SMILES |
OC(=O)CSC=1N(C=2C=CC(=CC2)OC)C(=NN1)C1=CC=CC=C1 |
![{[4-(p-Methoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]thio}acetic acid](/api/spectrum/3PYkhNGtBuj/structure.png?h=300&w=458 "{[4-(p-Methoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]thio}acetic acid")
