| SpectraBase Compound ID | 8zIMbKKjIIT |
|---|---|
| InChI | InChI=1S/C15H27Cl3O3/c1-2-3-4-5-6-7-8-9-10-11-12-20-14(19)21-13-15(16,17)18/h2-13H2,1H3 |
| InChIKey | SWYUFYXBVKPLFO-UHFFFAOYSA-N |
| Mol Weight | 361.74 g/mol |
| Molecular Formula | C15H27Cl3O3 |
| Exact Mass | 360.102578 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | K4tRKGDv6dR |
|---|---|
| Name | Carbonic acid, dodecyl 2,2,2-trichloroethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 360.102577826 u |
| Formula | C15H27Cl3O3 |
| InChI | InChI=1S/C15H27Cl3O3/c1-2-3-4-5-6-7-8-9-10-11-12-20-14(19)21-13-15(16,17)18/h2-13H2,1H3 |
| InChIKey | SWYUFYXBVKPLFO-UHFFFAOYSA-N |
| Molecular Weight | 361.737 g/mol |
| SMILES | C(COC(OCCCCCCCCCCCC)=O)(Cl)(Cl)Cl |