| SpectraBase Compound ID | 4RZCjE7uwEk |
|---|---|
| InChI | InChI=1S/C13H10N4/c1-2-4-10(5-3-1)12-15-13(17-16-12)11-6-8-14-9-7-11/h1-9H,(H,15,16,17) |
| InChIKey | FFKGGRPAHKNYHP-UHFFFAOYSA-N |
| Mol Weight | 222.25 g/mol |
| Molecular Formula | C13H10N4 |
| Exact Mass | 222.090546 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3t0BF9EGei6 |
|---|---|
| Name | 4-(5-Phenyl-2H-1,2,4-triazol-3-yl)pyridine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 222.090546338 u |
| Formula | C13H10N4 |
| InChI | InChI=1S/C13H10N4/c1-2-4-10(5-3-1)12-15-13(17-16-12)11-6-8-14-9-7-11/h1-9H,(H,15,16,17) |
| InChIKey | FFKGGRPAHKNYHP-UHFFFAOYSA-N |
| Molecular Weight | 222.251 g/mol |
| SMILES | C1=CC=CC=C1C=1N=C(C2=CC=NC=C2)NN1 |