![2-[4-Trifluoromethylbenzoyl]benzoic acid](/api/spectrum/JTZuYPgTHfX/structure.png?h=300&w=458 "2-[4-Trifluoromethylbenzoyl]benzoic acid")
| SpectraBase Compound ID | BHmDFHM5yKG |
|---|---|
| InChI | InChI=1S/C15H9F3O3/c16-15(17,18)10-7-5-9(6-8-10)13(19)11-3-1-2-4-12(11)14(20)21/h1-8H,(H,20,21) |
| InChIKey | WTUHFTDBRBCODT-UHFFFAOYSA-N |
| Mol Weight | 294.23 g/mol |
| Molecular Formula | C15H9F3O3 |
| Exact Mass | 294.050379 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JTZuYPgTHfX |
|---|---|
| Name | 2-[4-Trifluoromethylbenzoyl]benzoic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 294.050378636 u |
| Formula | C15H9F3O3 |
| InChI | InChI=1S/C15H9F3O3/c16-15(17,18)10-7-5-9(6-8-10)13(19)11-3-1-2-4-12(11)14(20)21/h1-8H,(H,20,21) |
| InChIKey | WTUHFTDBRBCODT-UHFFFAOYSA-N |
| Molecular Weight | 294.229 g/mol |
| SMILES | C(=O)(C1=C(C(O)=O)C=CC=C1)C1=CC=C(C=C1)C(F)(F)F |