| SpectraBase Compound ID | K8bbV3EweSe |
|---|---|
| InChI | InChI=1S/C21H32F2O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-25-21(24)19-15-14-18(22)17-20(19)23/h14-15,17H,2-13,16H2,1H3 |
| InChIKey | QHJNAEBVINEWAZ-UHFFFAOYSA-N |
| Mol Weight | 354.5 g/mol |
| Molecular Formula | C21H32F2O2 |
| Exact Mass | 354.237037 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FCzwCV6DAS2 |
|---|---|
| Name | 2,4-Difluorobenzoic acid, tetradecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 354.237036594 u |
| Formula | C21H32F2O2 |
| InChI | InChI=1S/C21H32F2O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-25-21(24)19-15-14-18(22)17-20(19)23/h14-15,17H,2-13,16H2,1H3 |
| InChIKey | QHJNAEBVINEWAZ-UHFFFAOYSA-N |
| Molecular Weight | 354.482 g/mol |
| SMILES | C(CCCCCCCCCOC(C1=C(C=C(C=C1)F)F)=O)CCCC |