SpectraBase Compound ID | 9ykvf0sRur9 |
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InChI | InChI=1S/C8H8Br2/c9-8(10)6-7-4-2-1-3-5-7/h1-5,8H,6H2 |
InChIKey | SYHAHHTUPPCPTM-UHFFFAOYSA-N |
Mol Weight | 263.96 g/mol |
Molecular Formula | C8H8Br2 |
Exact Mass | 261.899276 g/mol |
SpectraBase Spectrum ID | Gj4eGWHAgsk |
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Name | (2,2-Dibromoethyl)benzene |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 261.899276258 u |
Formula | C8H8Br2 |
InChI | InChI=1S/C8H8Br2/c9-8(10)6-7-4-2-1-3-5-7/h1-5,8H,6H2 |
InChIKey | SYHAHHTUPPCPTM-UHFFFAOYSA-N |
SMILES | C(CC=1C=CC=CC1)(Br)Br |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.977591 |