| SpectraBase Compound ID | LTxic4z5BIb |
|---|---|
| InChI | InChI=1S/C13H16F8O4/c1-3-11(4-2,9(22)24-5-12(18,19)7(14)15)10(23)25-6-13(20,21)8(16)17/h7-8H,3-6H2,1-2H3 |
| InChIKey | VBSGJIUBFQPHIH-UHFFFAOYSA-N |
| Mol Weight | 388.25 g/mol |
| Molecular Formula | C13H16F8O4 |
| Exact Mass | 388.092084 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9dkOKuV92MA |
|---|---|
| Name | Diethylmalonic acid, di(2,2,3,3-tetrafluoropropyl) ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 388.092084295 u |
| Formula | C13H16F8O4 |
| InChI | InChI=1S/C13H16F8O4/c1-3-11(4-2,9(22)24-5-12(18,19)7(14)15)10(23)25-6-13(20,21)8(16)17/h7-8H,3-6H2,1-2H3 |
| InChIKey | VBSGJIUBFQPHIH-UHFFFAOYSA-N |
| Molecular Weight | 388.254 g/mol |
| SMILES | C(C(C(OCC(C(F)F)(F)F)=O)(CC)CC)(OCC(C(F)F)(F)F)=O |