| SpectraBase Compound ID | 8cKCXKWYZgl |
|---|---|
| InChI | InChI=1S/C16H15BrO/c1-12(18)16(14-5-3-2-4-6-14)11-13-7-9-15(17)10-8-13/h2-10,16H,11H2,1H3 |
| InChIKey | HRDBNTPSBBIEEC-UHFFFAOYSA-N |
| Mol Weight | 303.2 g/mol |
| Molecular Formula | C16H15BrO |
| Exact Mass | 302.030628 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GT09yufOmJY |
|---|---|
| Name | 4-(4-Bromophenyl)-3-phenyl-2-butanone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 302.030628102 u |
| Formula | C16H15BrO |
| InChI | InChI=1S/C16H15BrO/c1-12(18)16(14-5-3-2-4-6-14)11-13-7-9-15(17)10-8-13/h2-10,16H,11H2,1H3 |
| InChIKey | HRDBNTPSBBIEEC-UHFFFAOYSA-N |
| SMILES | CC(C(CC=1C=CC(=CC1)Br)C=1C=CC=CC1)=O |