| SpectraBase Compound ID | Lcza066JtXl |
|---|---|
| InChI | InChI=1S/C15H20ClFO2/c16-11-5-3-1-2-4-6-12-19-15(18)13-7-9-14(17)10-8-13/h7-10H,1-6,11-12H2 |
| InChIKey | ZJUCYGIDNBMNTC-UHFFFAOYSA-N |
| Mol Weight | 286.77 g/mol |
| Molecular Formula | C15H20ClFO2 |
| Exact Mass | 286.113586 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EDPBGnGyoi8 |
|---|---|
| Name | 4-Fluorobenzoic acid, 8-chlorooctyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 286.113585745 u |
| Formula | C15H20ClFO2 |
| InChI | InChI=1S/C15H20ClFO2/c16-11-5-3-1-2-4-6-12-19-15(18)13-7-9-14(17)10-8-13/h7-10H,1-6,11-12H2 |
| InChIKey | ZJUCYGIDNBMNTC-UHFFFAOYSA-N |
| Molecular Weight | 286.774 g/mol |
| SMILES | C1(=CC=C(C=C1)F)C(=O)OCCCCCCCCCl |