| SpectraBase Compound ID | 20vmgTht1DB |
|---|---|
| InChI | InChI=1S/C19H29FO2/c1-2-3-4-5-6-7-8-9-10-11-16-22-19(21)17-12-14-18(20)15-13-17/h12-15H,2-11,16H2,1H3 |
| InChIKey | CCRZRYXYWSBEJX-UHFFFAOYSA-N |
| Mol Weight | 308.44 g/mol |
| Molecular Formula | C19H29FO2 |
| Exact Mass | 308.215158 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CoECCj7DT7G |
|---|---|
| Name | 4-Fluorobenzoic acid, dodecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 308.215158335 u |
| Formula | C19H29FO2 |
| InChI | InChI=1S/C19H29FO2/c1-2-3-4-5-6-7-8-9-10-11-16-22-19(21)17-12-14-18(20)15-13-17/h12-15H,2-11,16H2,1H3 |
| InChIKey | CCRZRYXYWSBEJX-UHFFFAOYSA-N |
| Molecular Weight | 308.437 g/mol |
| SMILES | CCCCCCCCCCCCOC(=O)C=1C=CC(F)=CC1 |