| SpectraBase Compound ID | ClLocTAJHcB |
|---|---|
| InChI | InChI=1S/C13H15FO2/c14-11-8-6-10(7-9-11)13(15)16-12-4-2-1-3-5-12/h6-9,12H,1-5H2 |
| InChIKey | BSOGKFNFXBTUMK-UHFFFAOYSA-N |
| Mol Weight | 222.26 g/mol |
| Molecular Formula | C13H15FO2 |
| Exact Mass | 222.105608 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | JCZdCxEq2dM |
|---|---|
| Name | 4-Fluorobenzoic acid, cyclohexyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 222.105607884 u |
| Formula | C13H15FO2 |
| InChI | InChI=1S/C13H15FO2/c14-11-8-6-10(7-9-11)13(15)16-12-4-2-1-3-5-12/h6-9,12H,1-5H2 |
| InChIKey | BSOGKFNFXBTUMK-UHFFFAOYSA-N |
| Molecular Weight | 222.259 g/mol |
| SMILES | C1CCCCC1OC(=O)C1=CC=C(F)C=C1 |