SpectraBase Spectrum ID |
HyOFbrQ2rEV |
Name |
4,5-bis[(2'-Tosylethyl)thio]-1,3-dithiole-2-thione |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
593.946136640 u |
Formula |
C21H22O6S7 |
InChI |
InChI=1S/C21H22O6S7/c1-15-3-7-17(8-4-15)33(22,23)26-11-13-29-19-20(32-21(28)31-19)30-14-12-27-34(24,25)18-9-5-16(2)6-10-18/h3-10H,11-14H2,1-2H3 |
InChIKey |
RCPLDRAWQJUKDE-UHFFFAOYSA-N |
Molecular Weight |
594.821 g/mol |
SMILES |
C1(SC(=C(S1)SCCOS(C1=CC=C(C=C1)C)(=O)=O)SCCOS(C1=CC=C(C=C1)C)(=O)=O)=S |