| SpectraBase Compound ID | Iq1CvZUOLFI |
|---|---|
| InChI | InChI=1S/C11H19Cl3O2/c1-2-3-4-5-6-7-8-10(15)16-9-11(12,13)14/h2-9H2,1H3 |
| InChIKey | UNSPRHCUPSMXLE-UHFFFAOYSA-N |
| Mol Weight | 289.63 g/mol |
| Molecular Formula | C11H19Cl3O2 |
| Exact Mass | 288.045063 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6aXBIQ6VrZt |
|---|---|
| Name | Nonanoic acid, 2,2,2-trichloroethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 288.045062950 u |
| Formula | C11H19Cl3O2 |
| InChI | InChI=1S/C11H19Cl3O2/c1-2-3-4-5-6-7-8-10(15)16-9-11(12,13)14/h2-9H2,1H3 |
| InChIKey | UNSPRHCUPSMXLE-UHFFFAOYSA-N |
| SMILES | C(COC(CCCCCCCC)=O)(Cl)(Cl)Cl |