| SpectraBase Compound ID | 3tM5ESQlPbe |
|---|---|
| InChI | InChI=1S/C15H14N4/c16-15-17-14(13-9-5-2-6-10-13)18-19(15)11-12-7-3-1-4-8-12/h1-10H,11H2,(H2,16,17,18) |
| InChIKey | BMGQCYDKLFQJFJ-UHFFFAOYSA-N |
| Mol Weight | 250.3 g/mol |
| Molecular Formula | C15H14N4 |
| Exact Mass | 250.121846 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 39LrQlR5iY |
|---|---|
| Name | 5-Amino-1-benzyl-3-phenyl-1H-1,2,4-triazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 250.121846467 u |
| Formula | C15H14N4 |
| InChI | InChI=1S/C15H14N4/c16-15-17-14(13-9-5-2-6-10-13)18-19(15)11-12-7-3-1-4-8-12/h1-10H,11H2,(H2,16,17,18) |
| InChIKey | BMGQCYDKLFQJFJ-UHFFFAOYSA-N |
| Molecular Weight | 250.305 g/mol |
| SMILES | NC1=NC(=NN1CC=1C=CC=CC1)C=1C=CC=CC1 |