Dataset

1H--13C heteronuclear single quantum coherence (1H-13C HSQC)

Chemical Information

InChI	InChI=1S/C13H14N2O4S/c1-9-4-6-10(7-5-9)20(16,17)11-8-14-13(19-3)15-12(11)18-2/h4-8H,1-3H3
SMILES	COc1nc(OC)ncc1S(=O)(=O)c1ccc(cc1)C
InChI Key	ZHYKLINAUYAJCN-UHFFFAOYSA-N
Exact Mass	294.326 g/mol

Data and Resources

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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/ZHYKLINAUYAJCN-UHFFFAOYSA-N/CHMO0001146
License URL
Source	https://www.chemotion-repository.net/inchikey/ZHYKLINAUYAJCN-UHFFFAOYSA-N/CHMO0001146
Version
Author	José Carlos Ferreira da Cunha
Maintainer	Chemotion Repository
Language	english
MetadataPublished	2026-01-20
Related Molecule

Field	Value
Measurement Technique	1H–13C heteronuclear single quantum coherence
Measurement Variables	title : Oct10-2024 date : 20241011 starting time : 1.05 h label : JFC-98 id : 327579 Solvent : chloroform-D1 (CDCl3) temperature : 298.0 K PULPROG : hsqcedetgpsisp2.3 number of scans : 4 scans instrument : Avance NEO

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