| SpectraBase Compound ID | 1qc9ObaxFlz |
|---|---|
| InChI | InChI=1S/C21H16Cl2O/c22-18-12-7-13-19(23)21(18)17(15-8-3-1-4-9-15)14-20(24)16-10-5-2-6-11-16/h1-13,17H,14H2 |
| InChIKey | PFTNMHXGKCJFLX-UHFFFAOYSA-N |
| Mol Weight | 355.26 g/mol |
| Molecular Formula | C21H16Cl2O |
| Exact Mass | 354.057821 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9dLpKvvqwIh |
|---|---|
| Name | 3-(2,6-Dichlorophenyl)-1,3-diphenyl-1-propanone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 354.057820534 u |
| Formula | C21H16Cl2O |
| InChI | InChI=1S/C21H16Cl2O/c22-18-12-7-13-19(23)21(18)17(15-8-3-1-4-9-15)14-20(24)16-10-5-2-6-11-16/h1-13,17H,14H2 |
| InChIKey | PFTNMHXGKCJFLX-UHFFFAOYSA-N |
| Molecular Weight | 355.264 g/mol |
| SMILES | C(C=1C(Cl)=CC=CC1Cl)(CC(=O)C1=CC=CC=C1)C=1C=CC=CC1 |