| SpectraBase Compound ID | HTTpN5X4ThS |
|---|---|
| InChI | InChI=1S/C13H14Cl2O2/c14-11-7-6-10(8-12(11)15)17-13(16)9-4-2-1-3-5-9/h6-9H,1-5H2 |
| InChIKey | JMJTVAZCYQSBSD-UHFFFAOYSA-N |
| Mol Weight | 273.16 g/mol |
| Molecular Formula | C13H14Cl2O2 |
| Exact Mass | 272.037085 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6bVmqAHj8yk |
|---|---|
| Name | Cyclohexanecarboxylic acid, 3,4-dichlorophenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 272.037085089 u |
| Formula | C13H14Cl2O2 |
| InChI | InChI=1S/C13H14Cl2O2/c14-11-7-6-10(8-12(11)15)17-13(16)9-4-2-1-3-5-9/h6-9H,1-5H2 |
| InChIKey | JMJTVAZCYQSBSD-UHFFFAOYSA-N |
| SMILES | C1CCCC(C1)C(OC=1C=CC(=C(C1)Cl)Cl)=O |