SpectraBase Compound ID | HvXF0FJzVry |
---|---|
InChI | InChI=1S/C8H8Br2/c9-6-5-7-3-1-2-4-8(7)10/h1-4H,5-6H2 |
InChIKey | RUGOFYNHMCFJFD-UHFFFAOYSA-N |
Mol Weight | 263.96 g/mol |
Molecular Formula | C8H8Br2 |
Exact Mass | 261.899276 g/mol |
SpectraBase Spectrum ID | 152uL8UUgaR |
---|---|
Name | 1-Bromo-2-(2-bromoethyl)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/c9-6-5-7-3-1-2-4-8(7)10/h1-4H,5-6H2 |
InChIKey | RUGOFYNHMCFJFD-UHFFFAOYSA-N |
SMILES | C1=C(C(=CC=C1)CCBr)Br |
Spectrum/Structure Validation Score (Raman) | 0.987837 |