| SpectraBase Compound ID | 4qXRTVqoYZP |
|---|---|
| InChI | InChI=1S/C17H18N4/c1-13(2)20-21-16(14-9-5-3-6-10-14)18-19-17(21)15-11-7-4-8-12-15/h3-13,20H,1-2H3 |
| InChIKey | NFXQTORIIJVOEK-UHFFFAOYSA-N |
| Mol Weight | 278.36 g/mol |
| Molecular Formula | C17H18N4 |
| Exact Mass | 278.153147 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4k6uJojDYav |
|---|---|
| Name | 3,5-Diphenyl-4-(isopropylamino)-4H-1,2,4-triazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 278.153146596 u |
| Formula | C17H18N4 |
| InChI | InChI=1S/C17H18N4/c1-13(2)20-21-16(14-9-5-3-6-10-14)18-19-17(21)15-11-7-4-8-12-15/h3-13,20H,1-2H3 |
| InChIKey | NFXQTORIIJVOEK-UHFFFAOYSA-N |
| Molecular Weight | 278.359 g/mol |
| SMILES | N(N1C(=NN=C1C1=CC=CC=C1)C=1C=CC=CC1)C(C)C |