| SpectraBase Compound ID | 4A6p29Ya2Tv |
|---|---|
| InChI | InChI=1S/C14H10Cl2O3/c1-18-10-4-2-3-9(7-10)14(17)19-11-5-6-12(15)13(16)8-11/h2-8H,1H3 |
| InChIKey | NKZQQSMRSOXSET-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 | 1Bh1LZPvgO8 |
|---|---|
| Name | m-Anisic acid, 3,4-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/c1-18-10-4-2-3-9(7-10)14(17)19-11-5-6-12(15)13(16)8-11/h2-8H,1H3 |
| InChIKey | NKZQQSMRSOXSET-UHFFFAOYSA-N |
| Molecular Weight | 297.137 g/mol |
| SMILES | C1(=CC=CC(=C1)C(OC1=CC(=C(C=C1)Cl)Cl)=O)OC |