| SpectraBase Compound ID | 4c2MPx6ApSb |
|---|---|
| InChI | InChI=1S/C10H15F3O4/c1-3-16-8(14)7(9(15)17-4-2)5-6-10(11,12)13/h7H,3-6H2,1-2H3 |
| InChIKey | FQXFYLMRHGXIQZ-UHFFFAOYSA-N |
| Mol Weight | 256.22 g/mol |
| Molecular Formula | C10H15F3O4 |
| Exact Mass | 256.092243 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GhcomjtoAjg |
|---|---|
| Name | 2-(3,3,3-Trifluoro-propyl)malonic acid diethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 256.092243448 u |
| Formula | C10H15F3O4 |
| InChI | InChI=1S/C10H15F3O4/c1-3-16-8(14)7(9(15)17-4-2)5-6-10(11,12)13/h7H,3-6H2,1-2H3 |
| InChIKey | FQXFYLMRHGXIQZ-UHFFFAOYSA-N |
| Molecular Weight | 256.221 g/mol |
| SMILES | C(C(=O)OCC)(C(=O)OCC)CCC(F)(F)F |