Dataset

1H nuclear magnetic resonance spectroscopy (1H NMR)

Chemical Info

InChI	InChI=1S/C20H20N2O3S2/c1-24-19(23)14-18(20-26-12-5-13-27-20)22-21-15-8-10-17(11-9-15)25-16-6-3-2-4-7-16/h2-4,6-11H,5,12-14H2,1H3/b22-21+
SMILES	COC(=O)CC(=C1SCCCS1)/N=N/c1ccc(cc1)Oc1ccccc1
InChI Key	AYVQXPXZSMDFGH-QURGRASLSA-N
Molecular Formula	C20H20N2O3S2
Exact Mass	400.514 g/mol

Data and Resources

• 1H nuclear magnetic resonance spectroscopy (1H NMR)HTML
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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/AYVQXPXZSMDFGH-QURGRASLSA-N/NMR/1H/CDCL3/250
License URL
Source	https://www.chemotion-repository.net/inchikey/AYVQXPXZSMDFGH-QURGRASLSA-N/NMR/1H/CDCL3/250
Version
Author	Bettina Stanek
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-06T22:49:10.491549
MetadataModified	2024-09-07T12:26:17.805446
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.