| SpectraBase Compound ID | F39yvEaC783 |
|---|---|
| InChI | InChI=1S/C9H8Br4O2/c1-14-8-5(11)4(3-10)6(12)9(15-2)7(8)13/h3H2,1-2H3 |
| InChIKey | UFHRWRWIBGROEM-UHFFFAOYSA-N |
| Mol Weight | 467.78 g/mol |
| Molecular Formula | C9H8Br4O2 |
| Exact Mass | 463.725781 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 8nTDZMNGxcf |
|---|---|
| Name | 3,5-Dimethoxy-alpha-2,4,6-tetrabromotoluene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 463.725781496 u |
| Formula | C9H8Br4O2 |
| InChI | InChI=1S/C9H8Br4O2/c1-14-8-5(11)4(3-10)6(12)9(15-2)7(8)13/h3H2,1-2H3 |
| InChIKey | UFHRWRWIBGROEM-UHFFFAOYSA-N |
| Molecular Weight | 467.777 g/mol |
| SMILES | C=1(C(=C(C(=C(C1Br)OC)Br)OC)Br)CBr |
| Spectrum/Structure Validation Score (Raman) | 0.862109 |