| SpectraBase Compound ID | 65jicUr3HAd |
|---|---|
| InChI | InChI=1S/C14H17FO2/c1-10(11-4-2-3-5-11)17-14(16)12-6-8-13(15)9-7-12/h6-11H,2-5H2,1H3 |
| InChIKey | OSQFPAWZXAHWGC-UHFFFAOYSA-N |
| Mol Weight | 236.29 g/mol |
| Molecular Formula | C14H17FO2 |
| Exact Mass | 236.121258 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5kIFVwa8nEp |
|---|---|
| Name | 4-Fluorobenzoic acid, 1-cyclopentylethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 236.121257948 u |
| Formula | C14H17FO2 |
| InChI | InChI=1S/C14H17FO2/c1-10(11-4-2-3-5-11)17-14(16)12-6-8-13(15)9-7-12/h6-11H,2-5H2,1H3 |
| InChIKey | OSQFPAWZXAHWGC-UHFFFAOYSA-N |
| Molecular Weight | 236.286 g/mol |
| SMILES | C1C(CCC1)C(C)OC(=O)C1=CC=C(F)C=C1 |