| SpectraBase Compound ID | E1IQPC6t22a |
|---|---|
| InChI | InChI=1S/C21H19N3O2/c22-20(25)17-12-18(14-23-13-17)21(26)24-19(16-9-5-2-6-10-16)11-15-7-3-1-4-8-15/h1-10,12-14,19H,11H2,(H2,22,25)(H,24,26) |
| InChIKey | MXYHEBRHAUUNMC-UHFFFAOYSA-N |
| Mol Weight | 345.4 g/mol |
| Molecular Formula | C21H19N3O2 |
| Exact Mass | 345.147727 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FANVIKTlLvM |
|---|---|
| Name | N-(1,2-Diphenylethyl)-3,5-pyridinedicarboxamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 345.147726862 u |
| Formula | C21H19N3O2 |
| InChI | InChI=1S/C21H19N3O2/c22-20(25)17-12-18(14-23-13-17)21(26)24-19(16-9-5-2-6-10-16)11-15-7-3-1-4-8-15/h1-10,12-14,19H,11H2,(H2,22,25)(H,24,26) |
| InChIKey | MXYHEBRHAUUNMC-UHFFFAOYSA-N |
| SMILES | NC(C=1C=C(C(=O)NC(CC=2C=CC=CC2)C=2C=CC=CC2)C=NC1)=O |