| SpectraBase Compound ID | 4nZMrQjOHyS |
|---|---|
| InChI | InChI=1S/C21H15ClO/c22-19-13-14-20(21(23)17-9-5-2-6-10-17)18(15-19)12-11-16-7-3-1-4-8-16/h1-15H/b12-11+ |
| InChIKey | KCCBAUDPMRWLOS-VAWYXSNFSA-N |
| Mol Weight | 318.8 g/mol |
| Molecular Formula | C21H15ClO |
| Exact Mass | 318.081143 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 620uFw7A1uQ |
|---|---|
| Name | (E)-(4-Chloro-2-styrylphenyl)(phenyl)methanone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 318.081142802 u |
| Formula | C21H15ClO |
| InChI | InChI=1S/C21H15ClO/c22-19-13-14-20(21(23)17-9-5-2-6-10-17)18(15-19)12-11-16-7-3-1-4-8-16/h1-15H/b12-11+ |
| InChIKey | KCCBAUDPMRWLOS-VAWYXSNFSA-N |
| Molecular Weight | 318.803 g/mol |
| SMILES | C=1(C(=O)C=2C=CC=CC2)C(\C=C\C=2C=CC=CC2)=CC(=CC1)Cl |