| SpectraBase Compound ID | 1JHUkJInpbu |
|---|---|
| InChI | InChI=1S/C9H14Cl4O3/c10-5-3-1-2-4-6-15-8(14)16-7-9(11,12)13/h1-7H2 |
| InChIKey | WUVSHBPRDMCGRL-UHFFFAOYSA-N |
| Mol Weight | 312.0 g/mol |
| Molecular Formula | C9H14Cl4O3 |
| Exact Mass | 309.969705 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AKFaAHkFAUD |
|---|---|
| Name | Carbonic acid, 6-chlorohexyl 2,2,2-trichloroethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 309.969705108 u |
| Formula | C9H14Cl4O3 |
| InChI | InChI=1S/C9H14Cl4O3/c10-5-3-1-2-4-6-15-8(14)16-7-9(11,12)13/h1-7H2 |
| InChIKey | WUVSHBPRDMCGRL-UHFFFAOYSA-N |
| Molecular Weight | 312.020 g/mol |
| SMILES | C(Cl)CCCCCOC(OCC(Cl)(Cl)Cl)=O |