| SpectraBase Compound ID | DeLJPaM1AZt |
|---|---|
| InChI | InChI=1S/C18H11F3O2/c19-18(20,21)15-7-3-6-14(10-15)17(22)23-16-9-8-12-4-1-2-5-13(12)11-16/h1-11H |
| InChIKey | GGUXZFJQGVPWCD-UHFFFAOYSA-N |
| Mol Weight | 316.28 g/mol |
| Molecular Formula | C18H11F3O2 |
| Exact Mass | 316.071114 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 14jcNjQCZBn |
|---|---|
| Name | 3-Trifluoromethylbenzoic acid, 2-naphthyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 316.071114081 u |
| Formula | C18H11F3O2 |
| InChI | InChI=1S/C18H11F3O2/c19-18(20,21)15-7-3-6-14(10-15)17(22)23-16-9-8-12-4-1-2-5-13(12)11-16/h1-11H |
| InChIKey | GGUXZFJQGVPWCD-UHFFFAOYSA-N |
| Molecular Weight | 316.279 g/mol |
| SMILES | C1(=CC=CC(=C1)C(OC=1C=CC2=CC=CC=C2C1)=O)C(F)(F)F |