![3-[5-(Pyridin-3-yl)-1H-1,2,4-triazol-3-yl]phenol](/api/spectrum/Kx1nifjXBQt/structure.png?h=300&w=458 "3-[5-(Pyridin-3-yl)-1H-1,2,4-triazol-3-yl]phenol")
| SpectraBase Compound ID | KdzduKjq4wI |
|---|---|
| InChI | InChI=1S/C13H10N4O/c18-11-5-1-3-9(7-11)12-15-13(17-16-12)10-4-2-6-14-8-10/h1-8,18H,(H,15,16,17) |
| InChIKey | NKTJSTFFPPFRAW-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 | Kx1nifjXBQt |
|---|---|
| Name | 3-[5-(Pyridin-3-yl)-1H-1,2,4-triazol-3-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/c18-11-5-1-3-9(7-11)12-15-13(17-16-12)10-4-2-6-14-8-10/h1-8,18H,(H,15,16,17) |
| InChIKey | NKTJSTFFPPFRAW-UHFFFAOYSA-N |
| Molecular Weight | 238.250 g/mol |
| SMILES | C1=CN=CC(C2=NC(C=3C=C(C=CC3)O)=NN2)=C1 |