Dataset

1H nuclear magnetic resonance spectroscopy (1H NMR)

Chemical Info

InChI	InChI=1S/C14H8F3NS/c1-7-2-3-11-12(4-7)19-14(18-11)8-5-9(15)13(17)10(16)6-8/h2-6H,1H3
SMILES	Cc1ccc2c(c1)sc(n2)c1cc(F)c(c(c1)F)F
InChI Key	KGPPSSIWSDMFRL-UHFFFAOYSA-N
Molecular Formula	C14H8F3NS
Exact Mass	279.280 g/mol

Data and Resources

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Metadata Information

• Additional
• Measurement

Field	Value
DOI	10.14272/KGPPSSIWSDMFRL-UHFFFAOYSA-N/CHMO0000593
License URL
Source	https://www.chemotion-repository.net/inchikey/KGPPSSIWSDMFRL-UHFFFAOYSA-N/CHMO0000593
Version
Author	Simone Gräßle
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T02:33:01.223346
MetadataModified	2024-09-07T17:07:30.828197
MetadataPublished	2020-02-28

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