Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

Chemical Info

InChI	InChI=1S/C13H11NO2S/c1-16-13(9-6-7-17-8-9)11-5-3-2-4-10(11)12(15)14-13/h2-8H,1H3,(H,14,15)
SMILES	COC1(NC(=O)c2c1cccc2)c1ccsc1
InChI Key	MJRRYZZDHRKPMP-UHFFFAOYSA-N
Molecular Formula	C13H11NO2S
Exact Mass	245.297 g/mol

Data and Resources

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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/MJRRYZZDHRKPMP-UHFFFAOYSA-N/CHMO0000595
License URL
Source	https://www.chemotion-repository.net/inchikey/MJRRYZZDHRKPMP-UHFFFAOYSA-N/CHMO0000595
Version
Author	Georg Manolikakes
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2025-01-29T10:32:40.249557
MetadataModified	2025-01-29T16:25:11.784917
MetadataPublished	2024-11-13

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

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