Dataset

19F nuclear magnetic resonance spectroscopy (19F NMR)

dataset for 19F nuclear magnetic resonance spectroscopy (19F NMR)\n\n

Chemical Info

molecular Image
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

Metadata Information

Field Value
DOI 10.14272/KGPPSSIWSDMFRL-UHFFFAOYSA-N/CHMO0000597
License URL
Source https://www.chemotion-repository.net/inchikey/KGPPSSIWSDMFRL-UHFFFAOYSA-N/CHMO0000597
Version
Author Simone Gräßle
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-07T02:32:54.727866
MetadataModified 2024-09-07T17:07:39.253091
MetadataPublished 2020-02-28
Field Value
Measurement Technique 19F nuclear magnetic resonance spectroscopy
Measurement Variables
Data-Source Molecule ID Data-Source
138453429 PubChem
The data in this table is sourced from UniChem at EBI.