| SpectraBase Compound ID | GDMdjN4pF75 |
|---|---|
| InChI | InChI=1S/C10H11BrO/c1-10(2,11)9(12)8-6-4-3-5-7-8/h3-7H,1-2H3 |
| InChIKey | QMOSZSHTSOWPRX-UHFFFAOYSA-N |
| Mol Weight | 227.1 g/mol |
| Molecular Formula | C10H11BrO |
| Exact Mass | 225.999328 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 8DDu8j62d1o |
|---|---|
| Name | 2-Bromo-2-methylpropiophenone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 225.999327973 u |
| Formula | C10H11BrO |
| InChI | InChI=1S/C10H11BrO/c1-10(2,11)9(12)8-6-4-3-5-7-8/h3-7H,1-2H3 |
| InChIKey | QMOSZSHTSOWPRX-UHFFFAOYSA-N |
| Molecular Weight | 227.101 g/mol |
| SMILES | C=1C(=CC=CC1)C(C(C)(Br)C)=O |
| Spectrum/Structure Validation Score (Raman) | 0.967356 |