| SpectraBase Compound ID | 2ApzYcUcB8i |
|---|---|
| InChI | InChI=1S/C20H19NO/c1-3-15-21(16-19-7-5-4-6-8-19)20(22)14-13-18-11-9-17(2)10-12-18/h1,4-14H,15-16H2,2H3/b14-13+ |
| InChIKey | QDVHYVWZIWTQDH-BUHFOSPRSA-N |
| Mol Weight | 289.38 g/mol |
| Molecular Formula | C20H19NO |
| Exact Mass | 289.146664 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | P2TYYqTwKg |
|---|---|
| Name | (E)-3-(4-Methylphenyl)-N-(phenylmethyl)-N-prop-2-ynyl-2-propenamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 289.146664235 u |
| Formula | C20H19NO |
| InChI | InChI=1S/C20H19NO/c1-3-15-21(16-19-7-5-4-6-8-19)20(22)14-13-18-11-9-17(2)10-12-18/h1,4-14H,15-16H2,2H3/b14-13+ |
| InChIKey | QDVHYVWZIWTQDH-BUHFOSPRSA-N |
| SMILES | C(\C=C\C=1C=CC(=CC1)C)(=O)N(CC#C)CC=1C=CC=CC1 |