Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

Chemical Info

InChI	InChI=1S/C17H20O3S/c1-17(2,3)13-20-21(18,19)12-11-15-9-6-8-14-7-4-5-10-16(14)15/h4-12H,13H2,1-3H3/b12-11+
SMILES	CC(COS(=O)(=O)/C=C/c1cccc2c1cccc2)(C)C
InChI Key	NNWNPNNOQFFLLH-VAWYXSNFSA-N
Molecular Formula	C17H20O3S
Exact Mass	304.404 g/mol

Data and Resources

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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/NNWNPNNOQFFLLH-VAWYXSNFSA-N/CHMO0000595
License URL
Source	https://www.chemotion-repository.net/inchikey/NNWNPNNOQFFLLH-VAWYXSNFSA-N/CHMO0000595
Version
Author	Georg Manolikakes
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2025-01-29T10:11:02.384555
MetadataModified	2025-01-29T16:04:24.103913
MetadataPublished	2024-10-15

Field	Value
Measurement Technique	13C nuclear magnetic resonance spectroscopy
Measurement Variables

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