Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

Chemical Information

InChI	InChI=1S/C15H19NO5S/c1-10-11-8-6-7-9-12(11)16(13(10)22(18,19)20-5)14(17)21-15(2,3)4/h6-9H,1-5H3
SMILES	COS(=O)(=O)c1c(C)c2c(n1C(=O)OC(C)(C)C)cccc2
InChI Key	PYLNSBKYGZPHCJ-UHFFFAOYSA-N
Exact Mass	325.380 g/mol

Data and Resources

• 13C nuclear magnetic resonance spectroscopy (13C NMR)HTML
  Go to source

• 13c-nuclear-magneti...

Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/PYLNSBKYGZPHCJ-UHFFFAOYSA-N/CHMO0000595
License URL
Source	https://www.chemotion-repository.net/inchikey/PYLNSBKYGZPHCJ-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 : 2025-07-07 Start time : 18:46:58 UTC Creator : Po-Chung Chien Label : PCC-956 ID : 148204 Solvent : CDCl3 Temperature : 297.146 K K Puls programme : zgpg30 Number of scans : 512 Instrument : spect Name : Parameter file, TOPSPIN Version 3.0 Version : Parameter file, TOPSPIN Version 3.0

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