| SpectraBase Compound ID | 9tJBcZuD1Rw |
|---|---|
| InChI | InChI=1S/C17H24F2O2/c1-2-3-4-5-6-7-8-9-12-21-17(20)15-11-10-14(18)13-16(15)19/h10-11,13H,2-9,12H2,1H3 |
| InChIKey | LSDJPQFERRSCQW-UHFFFAOYSA-N |
| Mol Weight | 298.37 g/mol |
| Molecular Formula | C17H24F2O2 |
| Exact Mass | 298.174436 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3r2KgX3tIY3 |
|---|---|
| Name | 2,4-Difluorobenzoic acid, decyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 298.174436337 u |
| Formula | C17H24F2O2 |
| InChI | InChI=1S/C17H24F2O2/c1-2-3-4-5-6-7-8-9-12-21-17(20)15-11-10-14(18)13-16(15)19/h10-11,13H,2-9,12H2,1H3 |
| InChIKey | LSDJPQFERRSCQW-UHFFFAOYSA-N |
| Molecular Weight | 298.374 g/mol |
| SMILES | C(COC(C1=C(C=C(C=C1)F)F)=O)CCCCCCCC |