| SpectraBase Compound ID | 8R6F1dDejGd |
|---|---|
| InChI | InChI=1S/C14H22F4O4/c1-4-5-6-7-8-21-11(19)13(2,3)12(20)22-9-14(17,18)10(15)16/h10H,4-9H2,1-3H3 |
| InChIKey | MIOLBVYLUHPWGC-UHFFFAOYSA-N |
| Mol Weight | 330.32 g/mol |
| Molecular Formula | C14H22F4O4 |
| Exact Mass | 330.145422 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ia7VVHEnkKY |
|---|---|
| Name | Dimethylmalonic acid, hexyl 2,2,3,3-tetrafluoropropyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 330.145421836 u |
| Formula | C14H22F4O4 |
| InChI | InChI=1S/C14H22F4O4/c1-4-5-6-7-8-21-11(19)13(2,3)12(20)22-9-14(17,18)10(15)16/h10H,4-9H2,1-3H3 |
| InChIKey | MIOLBVYLUHPWGC-UHFFFAOYSA-N |
| Molecular Weight | 330.320 g/mol |
| SMILES | CCCCCCOC(C(C(=O)OCC(C(F)F)(F)F)(C)C)=O |