| SpectraBase Compound ID | 9vs9RO7gWIg |
|---|---|
| InChI | InChI=1S/C17H20ClF5O2/c18-9-7-5-3-1-2-4-6-8-10-25-17(24)11-12(19)14(21)16(23)15(22)13(11)20/h1-10H2 |
| InChIKey | ZKMAZQLQJOWAHS-UHFFFAOYSA-N |
| Mol Weight | 386.79 g/mol |
| Molecular Formula | C17H20ClF5O2 |
| Exact Mass | 386.107198 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2xV8DjumINU |
|---|---|
| Name | 10-Chlorodecyl 2,3,4,5,6-pentafluorobenzoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 386.107198397 u |
| Formula | C17H20ClF5O2 |
| InChI | InChI=1S/C17H20ClF5O2/c18-9-7-5-3-1-2-4-6-8-10-25-17(24)11-12(19)14(21)16(23)15(22)13(11)20/h1-10H2 |
| InChIKey | ZKMAZQLQJOWAHS-UHFFFAOYSA-N |
| Molecular Weight | 386.790 g/mol |
| SMILES | C(=O)(C1=C(C(=C(C(=C1F)F)F)F)F)OCCCCCCCCCCCl |