| SpectraBase Compound ID | Wvc295LHrn |
|---|---|
| InChI | InChI=1S/C15H11ClO3/c16-13-8-4-7-12(9-13)15(18)19-10-14(17)11-5-2-1-3-6-11/h1-9H,10H2 |
| InChIKey | KAMMMIHJXGVKOM-UHFFFAOYSA-N |
| Mol Weight | 274.7 g/mol |
| Molecular Formula | C15H11ClO3 |
| Exact Mass | 274.039672 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BHJko53jFko |
|---|---|
| Name | Benzoic acid, 3-chloro-, 2-oxo-2-phenylethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 274.039671911 u |
| Formula | C15H11ClO3 |
| InChI | InChI=1S/C15H11ClO3/c16-13-8-4-7-12(9-13)15(18)19-10-14(17)11-5-2-1-3-6-11/h1-9H,10H2 |
| InChIKey | KAMMMIHJXGVKOM-UHFFFAOYSA-N |
| SMILES | C(OCC(=O)C1=CC=CC=C1)(=O)C1=CC(Cl)=CC=C1 |