| SpectraBase Compound ID | 16AM5PeO8dw |
|---|---|
| InChI | InChI=1S/C18H30F4O4/c1-4-5-6-7-8-9-10-11-12-25-15(23)17(2,3)16(24)26-13-18(21,22)14(19)20/h14H,4-13H2,1-3H3 |
| InChIKey | AVLUGEWOBUWULK-UHFFFAOYSA-N |
| Mol Weight | 386.43 g/mol |
| Molecular Formula | C18H30F4O4 |
| Exact Mass | 386.208022 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1LpQr3ibq7T |
|---|---|
| Name | Dimethylmalonic acid, decyl 2,2,3,3-tetrafluoropropyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 386.208022094 u |
| Formula | C18H30F4O4 |
| InChI | InChI=1S/C18H30F4O4/c1-4-5-6-7-8-9-10-11-12-25-15(23)17(2,3)16(24)26-13-18(21,22)14(19)20/h14H,4-13H2,1-3H3 |
| InChIKey | AVLUGEWOBUWULK-UHFFFAOYSA-N |
| Molecular Weight | 386.428 g/mol |
| SMILES | CCCCCCCCCCOC(C(C(=O)OCC(C(F)F)(F)F)(C)C)=O |