Dataset

1H nuclear magnetic resonance spectroscopy (1H NMR)

Chemical Info

InChI	InChI=1S/C13H17FN2S2/c1-2-12(13-17-8-3-9-18-13)16-15-11-6-4-10(14)5-7-11/h4-7,13,15H,2-3,8-9H2,1H3/b16-12+
SMILES	CC/C(=N\Nc1ccc(cc1)F)/C1SCCCS1
InChI Key	WWBBSKVQLPFKDZ-FOWTUZBSSA-N
Molecular Formula	C13H17FN2S2
Exact Mass	284.416 g/mol

Data and Resources

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Metadata Information

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• Molecule Data-Sources

Field	Value
DOI	10.14272/WWBBSKVQLPFKDZ-FOWTUZBSSA-N/NMR/1H/CDCl3/600
License URL
Source	https://www.chemotion-repository.net/inchikey/WWBBSKVQLPFKDZ-FOWTUZBSSA-N/NMR/1H/CDCl3/600
Version
Author	Nicole Jung
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-06T22:33:08.379711
MetadataModified	2024-09-07T11:52:16.396059
MetadataPublished	2014-05-27

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

Data-Source Molecule ID	Data-Source
73427250	PubChem
The data in this table is sourced from UniChem at EBI.