| SpectraBase Compound ID | BVv3t2LOmc1 |
|---|---|
| InChI | InChI=1S/C15H22F4O4/c16-14(17)15(18,19)10-23-13(21)8-4-7-12(20)22-9-11-5-2-1-3-6-11/h11,14H,1-10H2 |
| InChIKey | DYAVSACZYUFVCS-UHFFFAOYSA-N |
| Mol Weight | 342.33 g/mol |
| Molecular Formula | C15H22F4O4 |
| Exact Mass | 342.145422 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FT4chzp5m87 |
|---|---|
| Name | Glutaric acid, cyclohexylmethyl 2,2,3,3-tetrafluoropropyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 342.145421836 u |
| Formula | C15H22F4O4 |
| InChI | InChI=1S/C15H22F4O4/c16-14(17)15(18,19)10-23-13(21)8-4-7-12(20)22-9-11-5-2-1-3-6-11/h11,14H,1-10H2 |
| InChIKey | DYAVSACZYUFVCS-UHFFFAOYSA-N |
| Molecular Weight | 342.331 g/mol |
| SMILES | C(CCC(OCC1CCCCC1)=O)C(OCC(C(F)F)(F)F)=O |