Dataset

19F nuclear magnetic resonance spectroscopy (19F NMR)

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

Chemical Information

molecular Image
InChI InChI=1S/C13H8ClFN2/c14-10-5-3-7-17-8-12(16-13(10)17)9-4-1-2-6-11(9)15/h1-8H
SMILES Fc1ccccc1c1cn2c(n1)c(Cl)ccc2
InChI Key RITJJKBOMYWBLG-UHFFFAOYSA-N
Molecular Formula C13H8ClFN2
Exact Mass 246.667 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/RITJJKBOMYWBLG-UHFFFAOYSA-N/CHMO0000597
License URL
Source https://www.chemotion-repository.net/inchikey/RITJJKBOMYWBLG-UHFFFAOYSA-N/CHMO0000597
Version
Author Simone Gräßle
Maintainer Chemotion Repository
Language english
MetadataPublished 2023-03-03
Related Molecule
  • 8-chloro-2-(2-fluorophenyl)imidazo[1,2-a]pyridine
    • Field Value
    Measurement Technique 19F nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    ZINC000258028036 ZINC
    117137662 PubChem
    The data in this table is sourced from UniChem at EBI.