| SpectraBase Compound ID | 6gKdxjuU50k |
|---|---|
| InChI | InChI=1S/C8H6Br2O2/c1-4(11)6-2-5(9)3-7(10)8(6)12/h2-3,12H,1H3 |
| InChIKey | RCKHUOIKVIOMGZ-UHFFFAOYSA-N |
| Mol Weight | 293.94 g/mol |
| Molecular Formula | C8H6Br2O2 |
| Exact Mass | 291.873455 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 1GDTEsY2a7r |
|---|---|
| Name | 3',5'-Dibromo-2'-hydroxyacetophenone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 291.873455431 u |
| Formula | C8H6Br2O2 |
| InChI | InChI=1S/C8H6Br2O2/c1-4(11)6-2-5(9)3-7(10)8(6)12/h2-3,12H,1H3 |
| InChIKey | RCKHUOIKVIOMGZ-UHFFFAOYSA-N |
| SMILES | OC1=C(C=C(C=C1Br)Br)C(C)=O |
| Spectrum/Structure Validation Score (Raman) | 0.926127 |