![4H-3-Mercapto-5-(4-hydroxyphenyl)[1,2,4]triazole](/api/spectrum/9SHGe7mmYcQ/structure.png?h=300&w=458 "4H-3-Mercapto-5-(4-hydroxyphenyl)[1,2,4]triazole")
| SpectraBase Compound ID | IsdLgJYCfgD |
|---|---|
| InChI | InChI=1S/C8H7N3OS/c12-6-3-1-5(2-4-6)7-9-8(13)11-10-7/h1-4,12H,(H2,9,10,11,13) |
| InChIKey | GHQAENHMNKYJGV-UHFFFAOYSA-N |
| Mol Weight | 193.22 g/mol |
| Molecular Formula | C8H7N3OS |
| Exact Mass | 193.030983 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9SHGe7mmYcQ |
|---|---|
| Name | 4H-3-Mercapto-5-(4-hydroxyphenyl)[1,2,4]triazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 193.030983030 u |
| Formula | C8H7N3OS |
| InChI | InChI=1S/C8H7N3OS/c12-6-3-1-5(2-4-6)7-9-8(13)11-10-7/h1-4,12H,(H2,9,10,11,13) |
| InChIKey | GHQAENHMNKYJGV-UHFFFAOYSA-N |
| Molecular Weight | 193.224 g/mol |
| SMILES | OC1=CC=C(C2=NN=C(N2)S)C=C1 |