| SpectraBase Compound ID | JD33NGzquCM |
|---|---|
| InChI | InChI=1S/C8H5Br3/c9-7(8(10)11)6-4-2-1-3-5-6/h1-5H |
| InChIKey | JVPKLOPETWVKQD-UHFFFAOYSA-N |
| Mol Weight | 340.84 g/mol |
| Molecular Formula | C8H5Br3 |
| Exact Mass | 337.794139 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | FBFWeJkhaS9 |
|---|---|
| Name | alpha,beta,beta-Tribromostyrene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 337.794139161 u |
| Formula | C8H5Br3 |
| InChI | InChI=1S/C8H5Br3/c9-7(8(10)11)6-4-2-1-3-5-6/h1-5H |
| InChIKey | JVPKLOPETWVKQD-UHFFFAOYSA-N |
| Molecular Weight | 340.840 g/mol |
| SMILES | C=1C(=CC=CC1)C(=C(Br)Br)Br |
| Spectrum/Structure Validation Score (Raman) | 0.991911 |