| SpectraBase Compound ID | L3ssUMH16rU |
|---|---|
| InChI | InChI=1S/C21H17N3/c1-16-12-14-19(15-13-16)24-22-20(17-8-4-2-5-9-17)21(23-24)18-10-6-3-7-11-18/h2-15H,1H3 |
| InChIKey | HOXCLFIIQGHOQE-UHFFFAOYSA-N |
| Mol Weight | 311.39 g/mol |
| Molecular Formula | C21H17N3 |
| Exact Mass | 311.142248 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2LvdaUU2abr |
|---|---|
| Name | 2H-1,2,3-Triazole, 2-(4-methylphenyl)-4,5-diphenyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 311.142247559 u |
| Formula | C21H17N3 |
| InChI | InChI=1S/C21H17N3/c1-16-12-14-19(15-13-16)24-22-20(17-8-4-2-5-9-17)21(23-24)18-10-6-3-7-11-18/h2-15H,1H3 |
| InChIKey | HOXCLFIIQGHOQE-UHFFFAOYSA-N |
| Molecular Weight | 311.388 g/mol |
| SMILES | C1(=NN(N=C1C=1C=CC=CC1)C=1C=CC(=CC1)C)C1=CC=CC=C1 |