| SpectraBase Compound ID | 9smWv36pY8S |
|---|---|
| InChI | InChI=1S/C21H15ClO/c22-20-13-6-16(7-14-20)8-15-21(23)19-11-9-18(10-12-19)17-4-2-1-3-5-17/h1-15H |
| InChIKey | ITOPRUNXNYEDGQ-UHFFFAOYSA-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 | 68FeugQiV89 |
|---|---|
| Name | 4-Chloro-4'-phenylchalcone |
| 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/c22-20-13-6-16(7-14-20)8-15-21(23)19-11-9-18(10-12-19)17-4-2-1-3-5-17/h1-15H |
| InChIKey | ITOPRUNXNYEDGQ-UHFFFAOYSA-N |
| Molecular Weight | 318.803 g/mol |
| SMILES | C=1(Cl)C=CC(=CC1)C=CC(C1=CC=C(C=2C=CC=CC2)C=C1)=O |