| SpectraBase Compound ID | FiFKlEmc19Y |
|---|---|
| InChI | InChI=1S/C15H8F6O/c16-14(17,18)11-5-1-9(2-6-11)13(22)10-3-7-12(8-4-10)15(19,20)21/h1-8H |
| InChIKey | YHKDMJOYMRUGBQ-UHFFFAOYSA-N |
| Mol Weight | 318.22 g/mol |
| Molecular Formula | C15H8F6O |
| Exact Mass | 318.047934 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Fahi229jJFB |
|---|---|
| Name | bis-(4-Trifluoromethyl-phenyl)-methanone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 318.047933855 u |
| Formula | C15H8F6O |
| InChI | InChI=1S/C15H8F6O/c16-14(17,18)11-5-1-9(2-6-11)13(22)10-3-7-12(8-4-10)15(19,20)21/h1-8H |
| InChIKey | YHKDMJOYMRUGBQ-UHFFFAOYSA-N |
| Molecular Weight | 318.218 g/mol |
| SMILES | C(F)(C1=CC=C(C(C2=CC=C(C(F)(F)F)C=C2)=O)C=C1)(F)F |