| SpectraBase Compound ID | J03Pn6a4czJ |
|---|---|
| InChI | InChI=1S/C13H8BrFO/c14-11-5-1-3-9(7-11)13(16)10-4-2-6-12(15)8-10/h1-8H |
| InChIKey | KGAQUGKHKYDPDW-UHFFFAOYSA-N |
| Mol Weight | 279.11 g/mol |
| Molecular Formula | C13H8BrFO |
| Exact Mass | 277.974256 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JRyag5Nmoay |
|---|---|
| Name | (3-Bromophenyl)(3-fluorophenyl)methanone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 277.974256040 u |
| Formula | C13H8BrFO |
| InChI | InChI=1S/C13H8BrFO/c14-11-5-1-3-9(7-11)13(16)10-4-2-6-12(15)8-10/h1-8H |
| InChIKey | KGAQUGKHKYDPDW-UHFFFAOYSA-N |
| Molecular Weight | 279.108 g/mol |
| SMILES | C1(F)=CC(=CC=C1)C(=O)C1=CC(=CC=C1)Br |