| SpectraBase Compound ID | sDg3b5Coz6 |
|---|---|
| InChI | InChI=1S/C10H16ClF3O2/c11-7-5-3-1-2-4-6-8-16-9(15)10(12,13)14/h1-8H2 |
| InChIKey | JDQFWSUHVDQYFG-UHFFFAOYSA-N |
| Mol Weight | 260.68 g/mol |
| Molecular Formula | C10H16ClF3O2 |
| Exact Mass | 260.079092 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AZKzA3uE96W |
|---|---|
| Name | 8-Chloro-1-octanol, trifluoroacetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 260.079091942 u |
| Formula | C10H16ClF3O2 |
| InChI | InChI=1S/C10H16ClF3O2/c11-7-5-3-1-2-4-6-8-16-9(15)10(12,13)14/h1-8H2 |
| InChIKey | JDQFWSUHVDQYFG-UHFFFAOYSA-N |
| Molecular Weight | 260.684 g/mol |
| SMILES | C(Cl)CCCCCCCOC(C(F)(F)F)=O |