| SpectraBase Compound ID | GWX6kSOZuVC |
|---|---|
| InChI | InChI=1S/C8H14Cl2O2/c9-5-3-1-2-4-6-12-8(11)7-10/h1-7H2 |
| InChIKey | VNGMYNDYUJRSGC-UHFFFAOYSA-N |
| Mol Weight | 213.1 g/mol |
| Molecular Formula | C8H14Cl2O2 |
| Exact Mass | 212.037085 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9BnLvSLzD2h |
|---|---|
| Name | Chloroacetic acid, 6-chlorohexyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 212.037085089 u |
| Formula | C8H14Cl2O2 |
| InChI | InChI=1S/C8H14Cl2O2/c9-5-3-1-2-4-6-12-8(11)7-10/h1-7H2 |
| InChIKey | VNGMYNDYUJRSGC-UHFFFAOYSA-N |
| Molecular Weight | 213.104 g/mol |
| SMILES | C(C(=O)OCCCCCCCl)Cl |