| SpectraBase Compound ID | Fr8xmcSDPtb |
|---|---|
| InChI | InChI=1S/C15H11BrO/c16-14-9-7-13(8-10-14)15(17)11-6-12-4-2-1-3-5-12/h1-11H |
| InChIKey | QMHDTKUBDZUMNH-UHFFFAOYSA-N |
| Mol Weight | 287.16 g/mol |
| Molecular Formula | C15H11BrO |
| Exact Mass | 285.999328 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 8CwYXIWwINx |
|---|---|
| Name | 4'-Bromochalcone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 285.999327973 u |
| Formula | C15H11BrO |
| InChI | InChI=1S/C15H11BrO/c16-14-9-7-13(8-10-14)15(17)11-6-12-4-2-1-3-5-12/h1-11H |
| InChIKey | QMHDTKUBDZUMNH-UHFFFAOYSA-N |
| SMILES | C=1C(=CC=CC1)C=CC(C=1C=CC(=CC1)Br)=O |
| Spectrum/Structure Validation Score (Raman) | 0.993336 |