![1-Ethanone, 2,2,2-trifluoro-1-(4-(4-methylbenzoyl)-phenyl]](/api/spectrum/Ly8Xhp3iq4R/structure.png?h=300&w=458 "1-Ethanone, 2,2,2-trifluoro-1-(4-(4-methylbenzoyl)-phenyl]")
| SpectraBase Compound ID | 54McZxIvitR |
|---|---|
| InChI | InChI=1S/C16H11F3O2/c1-10-2-4-11(5-3-10)14(20)12-6-8-13(9-7-12)15(21)16(17,18)19/h2-9H,1H3 |
| InChIKey | GAHBPNJUMXMBCT-UHFFFAOYSA-N |
| Mol Weight | 292.26 g/mol |
| Molecular Formula | C16H11F3O2 |
| Exact Mass | 292.071114 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ly8Xhp3iq4R |
|---|---|
| Name | 1-Ethanone, 2,2,2-trifluoro-1-(4-(4-methylbenzoyl)-phenyl] |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 292.071114081 u |
| Formula | C16H11F3O2 |
| InChI | InChI=1S/C16H11F3O2/c1-10-2-4-11(5-3-10)14(20)12-6-8-13(9-7-12)15(21)16(17,18)19/h2-9H,1H3 |
| InChIKey | GAHBPNJUMXMBCT-UHFFFAOYSA-N |
| Molecular Weight | 292.257 g/mol |
| SMILES | C(=O)(C1=CC=C(C=C1)C)C1=CC=C(C(C(F)(F)F)=O)C=C1 |