Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

Chemical Information

InChI	InChI=1S/C12H12O5S2/c1-16-9-3-4-10-8(7-18-19(2,14)15)5-12(13)17-11(10)6-9/h3-6H,7H2,1-2H3
SMILES	COc1ccc2c(c1)oc(=O)cc2CSS(=O)(=O)C
InChI Key	KDBWPYOLTIIGFP-UHFFFAOYSA-N
Exact Mass	300.351 g/mol

Data and Resources

• 13C nuclear magnetic resonance spectroscopy (13C NMR)HTML
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• chmo0000595

Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/KDBWPYOLTIIGFP-UHFFFAOYSA-N/CHMO0000595
License URL
Source	https://www.chemotion-repository.net/inchikey/KDBWPYOLTIIGFP-UHFFFAOYSA-N/CHMO0000595
Version
Author	Lucie Wohlrábová
Maintainer	Chemotion Repository
Language	english
MetadataPublished	2025-10-27
Related Molecule

Field	Value
Measurement Technique	CHMO:0000595
Measurement Variables

Data-Source Molecule ID	Data-Source
No additional information available for this Dataset.