Dataset

1H nuclear magnetic resonance spectroscopy (1H NMR)

Chemical Info

InChI	InChI=1S/C15H17ClN2O2S2/c1-10-11(16)5-3-6-12(10)17-18-13(9-14(19)20-2)15-21-7-4-8-22-15/h3,5-6H,4,7-9H2,1-2H3/b18-17+
SMILES	COC(=O)CC(=C1SCCCS1)/N=N/c1cccc(c1C)Cl
InChI Key	JBSNCIVXJFJUSU-ISLYRVAYSA-N
Molecular Formula	C15H17ClN2O2S2
Exact Mass	356.891 g/mol

Data and Resources

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Metadata Information

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• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/JBSNCIVXJFJUSU-ISLYRVAYSA-N/NMR/1H/CDCL3/400
License URL
Source	https://www.chemotion-repository.net/inchikey/JBSNCIVXJFJUSU-ISLYRVAYSA-N/NMR/1H/CDCL3/400
Version
Author	Bettina Stanek
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-06T22:53:08.617904
MetadataModified	2024-09-07T12:15:31.324915
MetadataPublished	2014-05-27

Field	Value
Measurement Technique	1H nuclear magnetic resonance spectroscopy
Measurement Variables

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