| SpectraBase Compound ID | FRyalFyJzHl |
|---|---|
| InChI | InChI=1S/C15H11ClO3/c1-10(17)11-6-3-5-9-14(11)19-15(18)12-7-2-4-8-13(12)16/h2-9H,1H3 |
| InChIKey | MMUCFGXPKJKSGP-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 | Hqy20F9Lo3G |
|---|---|
| Name | Benzoic acid, 2-chloro-, 2-acetylphenyl 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/c1-10(17)11-6-3-5-9-14(11)19-15(18)12-7-2-4-8-13(12)16/h2-9H,1H3 |
| InChIKey | MMUCFGXPKJKSGP-UHFFFAOYSA-N |
| SMILES | C(C1=C(Cl)C=CC=C1)(OC1=C(C(=O)C)C=CC=C1)=O |