| SpectraBase Compound ID | GVxXKcDRoC0 |
|---|---|
| InChI | InChI=1S/C14H10Cl2O2/c1-9-4-2-5-10(8-9)14(17)18-12-7-3-6-11(15)13(12)16/h2-8H,1H3 |
| InChIKey | OTCVTJMXUYAIGT-UHFFFAOYSA-N |
| Mol Weight | 281.14 g/mol |
| Molecular Formula | C14H10Cl2O2 |
| Exact Mass | 280.005785 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KGbMUdYVxUV |
|---|---|
| Name | 3-Methylbenzoic acid, 2,3-dichlorophenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 280.005784960 u |
| Formula | C14H10Cl2O2 |
| InChI | InChI=1S/C14H10Cl2O2/c1-9-4-2-5-10(8-9)14(17)18-12-7-3-6-11(15)13(12)16/h2-8H,1H3 |
| InChIKey | OTCVTJMXUYAIGT-UHFFFAOYSA-N |
| Molecular Weight | 281.138 g/mol |
| SMILES | C(C1=CC(=CC=C1)C)(OC1=CC=CC(=C1Cl)Cl)=O |