| SpectraBase Compound ID | I9Cq5066TYw |
|---|---|
| InChI | InChI=1S/C14H10Cl2O3/c1-18-10-7-5-9(6-8-10)14(17)19-12-4-2-3-11(15)13(12)16/h2-8H,1H3 |
| InChIKey | ASQUQRUFJRWXMT-UHFFFAOYSA-N |
| Mol Weight | 297.14 g/mol |
| Molecular Formula | C14H10Cl2O3 |
| Exact Mass | 296.0007 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Dkh8vfTh9AH |
|---|---|
| Name | 4-Methoxybenzoic acid, 2,3-dichlorophenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 296.000699579 u |
| Formula | C14H10Cl2O3 |
| InChI | InChI=1S/C14H10Cl2O3/c1-18-10-7-5-9(6-8-10)14(17)19-12-4-2-3-11(15)13(12)16/h2-8H,1H3 |
| InChIKey | ASQUQRUFJRWXMT-UHFFFAOYSA-N |
| Molecular Weight | 297.137 g/mol |
| SMILES | C1(=CC=C(C=C1)OC)C(=O)OC1=CC=CC(=C1Cl)Cl |