| SpectraBase Compound ID | I4J98H3zK8v |
|---|---|
| InChI | InChI=1S/C14H8BrF3O/c15-12-7-3-10(4-8-12)13(19)9-1-5-11(6-2-9)14(16,17)18/h1-8H |
| InChIKey | WBTNCOKTRQISPJ-UHFFFAOYSA-N |
| Mol Weight | 329.12 g/mol |
| Molecular Formula | C14H8BrF3O |
| Exact Mass | 327.971062 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GjxeMGS82Pc |
|---|---|
| Name | 4-Bromo-4'-trifluoromethylbenzophenone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 327.971062366 u |
| Formula | C14H8BrF3O |
| InChI | InChI=1S/C14H8BrF3O/c15-12-7-3-10(4-8-12)13(19)9-1-5-11(6-2-9)14(16,17)18/h1-8H |
| InChIKey | WBTNCOKTRQISPJ-UHFFFAOYSA-N |
| Molecular Weight | 329.116 g/mol |
| SMILES | C(F)(F)(F)C1=CC=C(C=C1)C(=O)C=1C=CC(Br)=CC1 |