| SpectraBase Compound ID | 3bFXnIZLsYy |
|---|---|
| InChI | InChI=1S/C18H18ClNO/c1-12-10-13(2)18(14(3)11-12)20-17(21)9-6-15-4-7-16(19)8-5-15/h4-11H,1-3H3,(H,20,21)/b9-6+ |
| InChIKey | GSAPBEOOZDOZOK-RMKNXTFCSA-N |
| Mol Weight | 299.8 g/mol |
| Molecular Formula | C18H18ClNO |
| Exact Mass | 299.107692 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2yRWWFgOLd1 |
|---|---|
| Name | (2E)-3-(4-Chlorophenyl)-N-mesityl-2-propenamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 299.107691903 u |
| Formula | C18H18ClNO |
| InChI | InChI=1S/C18H18ClNO/c1-12-10-13(2)18(14(3)11-12)20-17(21)9-6-15-4-7-16(19)8-5-15/h4-11H,1-3H3,(H,20,21)/b9-6+ |
| InChIKey | GSAPBEOOZDOZOK-RMKNXTFCSA-N |
| SMILES | N(C1=C(C=C(C=C1C)C)C)C(\C=C\C1=CC=C(C=C1)Cl)=O |