| SpectraBase Compound ID | H0qRYxlsGc8 |
|---|---|
| InChI | InChI=1S/C8H8Br2O/c1-5-3-8(11-2)7(10)4-6(5)9/h3-4H,1-2H3 |
| InChIKey | CDLNHQVKSMDSAI-UHFFFAOYSA-N |
| Mol Weight | 279.96 g/mol |
| Molecular Formula | C8H8Br2O |
| Exact Mass | 277.894191 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 8mCSowWF0sZ |
|---|---|
| Name | 2,4-Dibromo-5-methylanisole |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 277.894190877 u |
| Formula | C8H8Br2O |
| InChI | InChI=1S/C8H8Br2O/c1-5-3-8(11-2)7(10)4-6(5)9/h3-4H,1-2H3 |
| InChIKey | CDLNHQVKSMDSAI-UHFFFAOYSA-N |
| SMILES | C=1C(=C(C=C(C1C)Br)Br)OC |
| Spectrum/Structure Validation Score (Raman) | 0.84455 |