SpectraBase Compound ID | 74LBypRqV2A |
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InChI | InChI=1S/C6H12Cl2OS2/c7-1-3-10-5-9-6-11-4-2-8/h1-6H2 |
InChIKey | IJGBNRTYNRKNHS-UHFFFAOYSA-N |
Mol Weight | 235.19 g/mol |
Molecular Formula | C6H12Cl2OS2 |
Exact Mass | 233.970663 g/mol |
SpectraBase Spectrum ID | FHfkVtY2HOY |
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Name | bis-(2-Chloroethylthiomethyl)-ether |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 233.970662753 u |
Formula | C6H12Cl2OS2 |
InChI | InChI=1S/C6H12Cl2OS2/c7-1-3-10-5-9-6-11-4-2-8/h1-6H2 |
InChIKey | IJGBNRTYNRKNHS-UHFFFAOYSA-N |
Molecular Weight | 235.187 g/mol |
SMILES | C(Cl)CSCOCSCCCl |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.936729 |