SpectraBase Compound ID | 3rfkmEvt3Re |
---|---|
InChI | InChI=1S/C4H8Br2OS/c5-1-3-8(7)4-2-6/h1-4H2 |
InChIKey | DRXUQRIPMTVDCS-UHFFFAOYSA-N |
Mol Weight | 263.97 g/mol |
Molecular Formula | C4H8Br2OS |
Exact Mass | 261.866262 g/mol |
SpectraBase Spectrum ID | LoD4wsBcRBq |
---|---|
Name | bis(2-Bromoethyl) sulfoxide |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 261.866262051 u |
Formula | C4H8Br2OS |
InChI | InChI=1S/C4H8Br2OS/c5-1-3-8(7)4-2-6/h1-4H2 |
InChIKey | DRXUQRIPMTVDCS-UHFFFAOYSA-N |
Molecular Weight | 263.975 g/mol |
SMILES | C(Br)CS(CCBr)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.927151 |