| SpectraBase Compound ID | 9ki7Vv6SDkS |
|---|---|
| InChI | InChI=1S/C26H42F2O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-30-26(29)23-19-20-24(27)25(28)22-23/h19-20,22H,2-18,21H2,1H3 |
| InChIKey | FELHFVQRWSTUFK-UHFFFAOYSA-N |
| Mol Weight | 424.6 g/mol |
| Molecular Formula | C26H42F2O2 |
| Exact Mass | 424.315287 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3Jcrn7dtlg3 |
|---|---|
| Name | 3,4-Difluorobenzoic acid, nonadecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 424.315286916 u |
| Formula | C26H42F2O2 |
| InChI | InChI=1S/C26H42F2O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-30-26(29)23-19-20-24(27)25(28)22-23/h19-20,22H,2-18,21H2,1H3 |
| InChIKey | FELHFVQRWSTUFK-UHFFFAOYSA-N |
| Molecular Weight | 424.617 g/mol |
| SMILES | C(CCCCCOC(C1=CC(=C(C=C1)F)F)=O)CCCCCCCCCCCCC |