Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

Chemical Information

InChI	InChI=1S/C11H10O3S2/c1-14-16(12,13)11-8-7-10(15-11)9-5-3-2-4-6-9/h2-8H,1H3
SMILES	COS(=O)(=O)c1ccc(s1)c1ccccc1
InChI Key	ONLDJTVNCHINKH-UHFFFAOYSA-N
Exact Mass	254.325 g/mol

Data and Resources

• 13C nuclear magnetic resonance spectroscopy (13C NMR)HTML
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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/ONLDJTVNCHINKH-UHFFFAOYSA-N/CHMO0000595
License URL
Source	https://www.chemotion-repository.net/inchikey/ONLDJTVNCHINKH-UHFFFAOYSA-N/CHMO0000595
Version
Author	Georg Manolikakes
Maintainer	Chemotion Repository
Language	english
MetadataPublished	2025-12-17
Related Molecule

Field	Value
Measurement Technique	13C nuclear magnetic resonance spectroscopy
Measurement Variables	Date : 2024-06-29 Start time : 00:36:45 UTC Creator : Po-Chung Chien Label : PCC-756 ID : 148004 Solvent : CDCl3 Temperature : 297.0439 K K Puls programme : zgpg30 Number of scans : 1024 Instrument : spect Name : Parameter file, TOPSPIN Version 3.0 Version : Parameter file, TOPSPIN Version 3.0

Data-Source Molecule ID	Data-Source
177807907	pubchem
The data in this table is sourced from UniChem at EBI.