| SpectraBase Compound ID | 3GD10qhMn6 |
|---|---|
| InChI | InChI=1S/C18H33Cl3O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-23-17(22)18(19,20)21/h2-16H2,1H3 |
| InChIKey | CCFJXGUHYQBXDT-UHFFFAOYSA-N |
| Mol Weight | 387.8 g/mol |
| Molecular Formula | C18H33Cl3O2 |
| Exact Mass | 386.154613 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BcmFJMYAjnF |
|---|---|
| Name | Trichloroacetic acid, hexadecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 386.154613401 u |
| Formula | C18H33Cl3O2 |
| InChI | InChI=1S/C18H33Cl3O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-23-17(22)18(19,20)21/h2-16H2,1H3 |
| InChIKey | CCFJXGUHYQBXDT-UHFFFAOYSA-N |
| Molecular Weight | 387.819 g/mol |
| SMILES | CCCCCCCCCCCCCCCCOC(=O)C(Cl)(Cl)Cl |