| SpectraBase Compound ID | EWftLEUGx86 |
|---|---|
| InChI | InChI=1S/C20H31FO2/c1-2-3-4-5-6-7-8-9-10-11-14-17-23-20(22)18-15-12-13-16-19(18)21/h12-13,15-16H,2-11,14,17H2,1H3 |
| InChIKey | RFOGIGPISNRLSL-UHFFFAOYSA-N |
| Mol Weight | 322.46 g/mol |
| Molecular Formula | C20H31FO2 |
| Exact Mass | 322.230808 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5HEqYz9mrUc |
|---|---|
| Name | 2-Fluorobenzoic acid, tridecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 322.230808399 u |
| Formula | C20H31FO2 |
| InChI | InChI=1S/C20H31FO2/c1-2-3-4-5-6-7-8-9-10-11-14-17-23-20(22)18-15-12-13-16-19(18)21/h12-13,15-16H,2-11,14,17H2,1H3 |
| InChIKey | RFOGIGPISNRLSL-UHFFFAOYSA-N |
| Molecular Weight | 322.464 g/mol |
| SMILES | CCCCCCCCCCCCCOC(=O)C1=CC=CC=C1F |