![o-[3-(2-Pyridyl)-S-triazol-5-yl] phenol](/api/spectrum/BOCNIKhuhgS/structure.png?h=300&w=458 "o-[3-(2-Pyridyl)-S-triazol-5-yl] phenol")
| SpectraBase Compound ID | Bxn2q9JHTwm |
|---|---|
| InChI | InChI=1S/C13H10N4O/c18-11-7-2-1-5-9(11)12-15-13(17-16-12)10-6-3-4-8-14-10/h1-8,18H,(H,15,16,17) |
| InChIKey | XIHFGQFLZWWLPW-UHFFFAOYSA-N |
| Mol Weight | 238.25 g/mol |
| Molecular Formula | C13H10N4O |
| Exact Mass | 238.085461 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BOCNIKhuhgS |
|---|---|
| Name | o-[3-(2-Pyridyl)-S-triazol-5-yl] phenol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 238.085460957 u |
| Formula | C13H10N4O |
| InChI | InChI=1S/C13H10N4O/c18-11-7-2-1-5-9(11)12-15-13(17-16-12)10-6-3-4-8-14-10/h1-8,18H,(H,15,16,17) |
| InChIKey | XIHFGQFLZWWLPW-UHFFFAOYSA-N |
| Molecular Weight | 238.250 g/mol |
| SMILES | N1C(C=2C(=CC=CC2)O)=NC(=N1)C=1N=CC=CC1 |