| SpectraBase Spectrum ID |
J9SXs1xCZ6C |
| Name |
4-Benzoyl-4'-bromobiphenyl |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
336.014978038 u |
| Formula |
C19H13BrO |
| InChI |
InChI=1S/C19H13BrO/c20-18-12-10-15(11-13-18)14-6-8-17(9-7-14)19(21)16-4-2-1-3-5-16/h1-13H |
| InChIKey |
ITMLYLPKSFZCJK-UHFFFAOYSA-N |
| Molecular Weight |
337.216 g/mol |
| SMILES |
C(C=1C=CC(=CC1)C=1C=CC(=CC1)Br)(=O)C1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Raman) |
0.954123 |
