Dataset

mass spectrometry (MS)

Chemical Information

InChI	InChI=1S/C15H18O3S2/c1-15(2,3)11-18-20(16,17)14-10-9-13(19-14)12-7-5-4-6-8-12/h4-10H,11H2,1-3H3
SMILES	CC(COS(=O)(=O)c1ccc(s1)c1ccccc1)(C)C
InChI Key	HOKPSMGUKHTKOS-UHFFFAOYSA-N
Exact Mass	310.432 g/mol

Data and Resources

• mass spectrometry (MS)HTML
  Go to source

• mass-spectrometry

Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/HOKPSMGUKHTKOS-UHFFFAOYSA-N/CHMO0000470
License URL
Source	https://www.chemotion-repository.net/inchikey/HOKPSMGUKHTKOS-UHFFFAOYSA-N/CHMO0000470
Version
Author	Georg Manolikakes
Maintainer	Chemotion Repository
Language	english
MetadataPublished	2025-12-17
Related Molecule

Field	Value
Measurement Technique	mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
177807913	pubchem
The data in this table is sourced from UniChem at EBI.