| SpectraBase Compound ID | AXR2BMngwWK |
|---|---|
| InChI | InChI=1S/C13H8BrF3O/c14-11-5-1-9(2-6-11)10-3-7-12(8-4-10)18-13(15,16)17/h1-8H |
| InChIKey | SOJDIXJKGSONDR-UHFFFAOYSA-N |
| Mol Weight | 317.11 g/mol |
| Molecular Formula | C13H8BrF3O |
| Exact Mass | 315.971062 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GCYasvm9YCl |
|---|---|
| Name | 4-Bromo-4'-trifluoromethoxybiphenyl |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 315.971062366 u |
| Formula | C13H8BrF3O |
| InChI | InChI=1S/C13H8BrF3O/c14-11-5-1-9(2-6-11)10-3-7-12(8-4-10)18-13(15,16)17/h1-8H |
| InChIKey | SOJDIXJKGSONDR-UHFFFAOYSA-N |
| Molecular Weight | 317.105 g/mol |
| SMILES | C=1(C=CC(=CC1)Br)C=1C=CC(=CC1)OC(F)(F)F |