| SpectraBase Compound ID | GPmrNvgikrg |
|---|---|
| InChI | InChI=1S/C9H8Cl2O2/c1-2-9(12)13-8-4-3-6(10)5-7(8)11/h3-5H,2H2,1H3 |
| InChIKey | FXRBLZFPWONVMH-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 | 7etquhL8sYH |
|---|---|
| Name | Phenol, 2,4-dichloro-, propionate; propionic acid, 2,4-dichlorophenyl ester |
| 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/c1-2-9(12)13-8-4-3-6(10)5-7(8)11/h3-5H,2H2,1H3 |
| InChIKey | FXRBLZFPWONVMH-UHFFFAOYSA-N |
| Molecular Weight | 219.067 g/mol |
| SMILES | C1=CC(=C(C=C1Cl)Cl)OC(CC)=O |