| SpectraBase Compound ID | Gsi9PRPdCu2 |
|---|---|
| InChI | InChI=1S/C11H7Cl2F5O2/c12-7-2-1-6(8(13)5-7)3-4-20-9(19)10(14,15)11(16,17)18/h1-2,5H,3-4H2 |
| InChIKey | UBOQQQZHFHVWOA-UHFFFAOYSA-N |
| Mol Weight | 337.07 g/mol |
| Molecular Formula | C11H7Cl2F5O2 |
| Exact Mass | 335.974326 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ITTsAwVeD9G |
|---|---|
| Name | 2,4-Dichlorophenethyl alcohol, pentafluoropropionate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 335.974325678 u |
| Formula | C11H7Cl2F5O2 |
| InChI | InChI=1S/C11H7Cl2F5O2/c12-7-2-1-6(8(13)5-7)3-4-20-9(19)10(14,15)11(16,17)18/h1-2,5H,3-4H2 |
| InChIKey | UBOQQQZHFHVWOA-UHFFFAOYSA-N |
| Molecular Weight | 337.073 g/mol |
| SMILES | C1(=C(C=C(C=C1)Cl)Cl)CCOC(C(C(F)(F)F)(F)F)=O |