Dataset

1H nuclear magnetic resonance spectroscopy (1H NMR)

Chemical Info

InChI	InChI=1S/C17H15BrN2OS2/c18-16(17-22-11-4-12-23-17)20-19-13-7-9-15(10-8-13)21-14-5-2-1-3-6-14/h1-3,5-10H,4,11-12H2/b20-19+
SMILES	BrC(=C1SCCCS1)/N=N/c1ccc(cc1)Oc1ccccc1
InChI Key	AOQRZPCEVXTULO-FMQUCBEESA-N
Molecular Formula	C17H15BrN2OS2
Exact Mass	407.348 g/mol

Data and Resources

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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/AOQRZPCEVXTULO-FMQUCBEESA-N/NMR/1H/CDCl3/300
License URL
Source	https://www.chemotion-repository.net/inchikey/AOQRZPCEVXTULO-FMQUCBEESA-N/NMR/1H/CDCl3/300
Version
Author	Bettina Stanek
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-06T22:57:28.412450
MetadataModified	2024-09-07T12:27:05.739164
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.