| SpectraBase Compound ID | 37rnUwoXDD2 |
|---|---|
| InChI | InChI=1S/C15H27FO4/c1-3-5-7-13(4-2)12-20-15(18)9-6-8-14(17)19-11-10-16/h13H,3-12H2,1-2H3 |
| InChIKey | VLMRTSFIKYZUFT-UHFFFAOYSA-N |
| Mol Weight | 290.38 g/mol |
| Molecular Formula | C15H27FO4 |
| Exact Mass | 290.189338 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 68zfWE1qfL6 |
|---|---|
| Name | Glutaric acid, 2-ethylhexyl 2-fluoroethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 290.189337508 u |
| Formula | C15H27FO4 |
| InChI | InChI=1S/C15H27FO4/c1-3-5-7-13(4-2)12-20-15(18)9-6-8-14(17)19-11-10-16/h13H,3-12H2,1-2H3 |
| InChIKey | VLMRTSFIKYZUFT-UHFFFAOYSA-N |
| Molecular Weight | 290.375 g/mol |
| SMILES | C(CCC(OCC(CC)CCCC)=O)C(OCCF)=O |