Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

Chemical Info

InChI	InChI=1S/C6H8N2O2S/c7-8-11(9,10)6-4-2-1-3-5-6/h1-5,8H,7H2
SMILES	NNS(=O)(=O)c1ccccc1
InChI Key	VJRITMATACIYAF-UHFFFAOYSA-N
Exact Mass	172.205 g/mol

Data and Resources

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

• Additional
• Measurement

Field	Value
DOI	10.14272/VJRITMATACIYAF-UHFFFAOYSA-N/CHMO0000595
License URL
Source	https://www.chemotion-repository.net/inchikey/VJRITMATACIYAF-UHFFFAOYSA-N/CHMO0000595
Version
Author	Simone Gräßle
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-08T01:51:21.814326
MetadataModified	2024-09-23T09:20:59.678170
MetadataPublished	2023-11-07

Field	Value
Measurement Technique	13C nuclear magnetic resonance spectroscopy
Measurement Variables	Temperature : 300.0 K K Puls programme : zgpg30 Number of scans : 512 Title : SG-CCP-3659 Date : 20231103 Start time : 21.28 h Instrument : spect Label : CCP-3488 ID : 281626 Solvent : DMSO