| SpectraBase Compound ID | FI8Sa3w3hRC |
|---|---|
| InChI | InChI=1S/C12H18F4O4/c1-8(2)6-19-9(17)4-3-5-10(18)20-7-12(15,16)11(13)14/h8,11H,3-7H2,1-2H3 |
| InChIKey | ANYSABBYQDBCRI-UHFFFAOYSA-N |
| Mol Weight | 302.27 g/mol |
| Molecular Formula | C12H18F4O4 |
| Exact Mass | 302.114122 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GiDXLf7K6tz |
|---|---|
| Name | Glutaric acid, 2,2,3,3-tetrafluoropropyl isobutyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 302.114121708 u |
| Formula | C12H18F4O4 |
| InChI | InChI=1S/C12H18F4O4/c1-8(2)6-19-9(17)4-3-5-10(18)20-7-12(15,16)11(13)14/h8,11H,3-7H2,1-2H3 |
| InChIKey | ANYSABBYQDBCRI-UHFFFAOYSA-N |
| Molecular Weight | 302.266 g/mol |
| SMILES | C(CCC(OCC(C(F)F)(F)F)=O)C(OCC(C)C)=O |