| SpectraBase Compound ID | De7SHsmS13q |
|---|---|
| InChI | InChI=1S/C12H22F2O2/c1-3-5-6-7-8-9-10-12(13,14)11(15)16-4-2/h3-10H2,1-2H3 |
| InChIKey | IXQGCPQCPWFTIW-UHFFFAOYSA-N |
| Mol Weight | 236.3 g/mol |
| Molecular Formula | C12H22F2O2 |
| Exact Mass | 236.158786 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1acZR6x45HQ |
|---|---|
| Name | Ethyl-2,2-difluorodecanoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 236.158786272 u |
| Formula | C12H22F2O2 |
| InChI | InChI=1S/C12H22F2O2/c1-3-5-6-7-8-9-10-12(13,14)11(15)16-4-2/h3-10H2,1-2H3 |
| InChIKey | IXQGCPQCPWFTIW-UHFFFAOYSA-N |
| Molecular Weight | 236.303 g/mol |
| SMILES | C(=O)(OCC)C(F)(F)CCCCCCCC |