| SpectraBase Compound ID | 8LOzRXIMnkF |
|---|---|
| InChI | InChI=1S/C19H26F4O2/c1-2-3-4-5-6-7-8-9-10-14-25-18(24)15-12-11-13-16(17(15)20)19(21,22)23/h11-13H,2-10,14H2,1H3 |
| InChIKey | SPZBMWMNRGZOJI-UHFFFAOYSA-N |
| Mol Weight | 362.41 g/mol |
| Molecular Formula | C19H26F4O2 |
| Exact Mass | 362.186893 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6NHhAKO5Mtn |
|---|---|
| Name | 2-Fluoro-3-trifluoromethylbenzoic acid, undecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 362.186892727 u |
| Formula | C19H26F4O2 |
| InChI | InChI=1S/C19H26F4O2/c1-2-3-4-5-6-7-8-9-10-14-25-18(24)15-12-11-13-16(17(15)20)19(21,22)23/h11-13H,2-10,14H2,1H3 |
| InChIKey | SPZBMWMNRGZOJI-UHFFFAOYSA-N |
| Molecular Weight | 362.409 g/mol |
| SMILES | CCCCCCCCCCCOC(C1=C(C(=CC=C1)C(F)(F)F)F)=O |