| SpectraBase Compound ID | D64UK9x8Ifx |
|---|---|
| InChI | InChI=1S/C15H20F2O2/c1-3-5-7-11(4-2)10-19-15(18)14-12(16)8-6-9-13(14)17/h6,8-9,11H,3-5,7,10H2,1-2H3 |
| InChIKey | VWDLUCGAXXIIRB-UHFFFAOYSA-N |
| Mol Weight | 270.32 g/mol |
| Molecular Formula | C15H20F2O2 |
| Exact Mass | 270.143136 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LNPjUuyH1DV |
|---|---|
| Name | 2,6-Difluorobenzoic acid, 2-ethylhexyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 270.143136208 u |
| Formula | C15H20F2O2 |
| InChI | InChI=1S/C15H20F2O2/c1-3-5-7-11(4-2)10-19-15(18)14-12(16)8-6-9-13(14)17/h6,8-9,11H,3-5,7,10H2,1-2H3 |
| InChIKey | VWDLUCGAXXIIRB-UHFFFAOYSA-N |
| Molecular Weight | 270.320 g/mol |
| SMILES | C(OC(C1=C(C=CC=C1F)F)=O)C(CCCC)CC |