| SpectraBase Compound ID | FFdM9t5BXk6 |
|---|---|
| InChI | InChI=1S/C15H21FO2/c1-2-3-4-5-6-7-12-18-15(17)13-8-10-14(16)11-9-13/h8-11H,2-7,12H2,1H3 |
| InChIKey | UBHONIKNSZVGMQ-UHFFFAOYSA-N |
| Mol Weight | 252.33 g/mol |
| Molecular Formula | C15H21FO2 |
| Exact Mass | 252.152558 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3TLbc2ATqs0 |
|---|---|
| Name | 4-Fluorobenzoic acid, octyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 252.152558077 u |
| Formula | C15H21FO2 |
| InChI | InChI=1S/C15H21FO2/c1-2-3-4-5-6-7-12-18-15(17)13-8-10-14(16)11-9-13/h8-11H,2-7,12H2,1H3 |
| InChIKey | UBHONIKNSZVGMQ-UHFFFAOYSA-N |
| Molecular Weight | 252.329 g/mol |
| SMILES | CCCCCCCCOC(=O)C=1C=CC(F)=CC1 |