Dataset

1H nuclear magnetic resonance spectroscopy (1H NMR)

dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR)\n\n

Chemical Info

molecular Image
InChI InChI=1S/C14H8F3NS/c15-14(16,17)10-6-7-12-11(8-10)18-13(19-12)9-4-2-1-3-5-9/h1-8H
SMILES FC(c1ccc2c(c1)nc(s2)c1ccccc1)(F)F
InChI Key PDVSHXSSPVXJNH-UHFFFAOYSA-N
Molecular Formula C14H8F3NS
Exact Mass 279.280 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/PDVSHXSSPVXJNH-UHFFFAOYSA-N/CHMO0000593
License URL
Source https://www.chemotion-repository.net/inchikey/PDVSHXSSPVXJNH-UHFFFAOYSA-N/CHMO0000593
Version
Author Simone Gräßle
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-07T02:29:48.714607
MetadataModified 2024-09-07T17:03:03.085889
MetadataPublished 2020-02-28
Field Value
Measurement Technique 1H nuclear magnetic resonance spectroscopy
Measurement Variables