SpectraBase Compound ID | JZAA5usDly4 |
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InChI | InChI=1S/C6H3Cl3O2S/c7-4-2-1-3-5(8)6(4)12(9,10)11/h1-3H |
InChIKey | WGGKQIKICKLWGN-UHFFFAOYSA-N |
Mol Weight | 245.51 g/mol |
Molecular Formula | C6H3Cl3O2S |
Exact Mass | 243.891934 g/mol |
SpectraBase Spectrum ID | CMe11vGbQdU |
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Name | 2,6-Dichlorobenzenesulfonyl chloride |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 243.891933609 u |
Formula | C6H3Cl3O2S |
InChI | InChI=1S/C6H3Cl3O2S/c7-4-2-1-3-5(8)6(4)12(9,10)11/h1-3H |
InChIKey | WGGKQIKICKLWGN-UHFFFAOYSA-N |
Molecular Weight | 245.507 g/mol |
SMILES | C1=C(C(=C(C=C1)Cl)S(=O)(=O)Cl)Cl |
Spectrum/Structure Validation Score (Raman) | 0.844904 |