| SpectraBase Compound ID | DwjAlvxrVoj |
|---|---|
| InChI | InChI=1S/C16H10F6O/c17-15(18,19)12-5-1-10(2-6-12)9-14(23)11-3-7-13(8-4-11)16(20,21)22/h1-8H,9H2 |
| InChIKey | WYRFXZKUYBWZFY-UHFFFAOYSA-N |
| Mol Weight | 332.25 g/mol |
| Molecular Formula | C16H10F6O |
| Exact Mass | 332.063584 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ka1urq2KBcH |
|---|---|
| Name | p-Trifluoromethylbenzyl p-trifluoromethylphenyl ketone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 332.063583919 u |
| Formula | C16H10F6O |
| InChI | InChI=1S/C16H10F6O/c17-15(18,19)12-5-1-10(2-6-12)9-14(23)11-3-7-13(8-4-11)16(20,21)22/h1-8H,9H2 |
| InChIKey | WYRFXZKUYBWZFY-UHFFFAOYSA-N |
| Molecular Weight | 332.245 g/mol |
| SMILES | C1=C(C=CC(=C1)CC(=O)C1=CC=C(C=C1)C(F)(F)F)C(F)(F)F |