| SpectraBase Compound ID | GWhCxkcBswx |
|---|---|
| InChI | InChI=1S/C9H8Cl2O2/c10-7-3-1-6(8(11)5-7)2-4-9(12)13/h1,3,5H,2,4H2,(H,12,13) |
| InChIKey | HLNPVFSCAMKIOD-UHFFFAOYSA-N |
| Mol Weight | 219.07 g/mol |
| Molecular Formula | C9H8Cl2O2 |
| Exact Mass | 217.990135 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 82WnKOS66T3 |
|---|---|
| Name | 3-(2,4-Dichlorophenyl)propionic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 217.990134896 u |
| Formula | C9H8Cl2O2 |
| InChI | InChI=1S/C9H8Cl2O2/c10-7-3-1-6(8(11)5-7)2-4-9(12)13/h1,3,5H,2,4H2,(H,12,13) |
| InChIKey | HLNPVFSCAMKIOD-UHFFFAOYSA-N |
| Molecular Weight | 219.067 g/mol |
| SMILES | OC(CCC1=CC=C(C=C1Cl)Cl)=O |