Dataset

nuclear magnetic resonance spectroscopy (NMR)

dataset for nuclear magnetic resonance spectroscopy (NMR)

Chemical Information

molecular Image
InChI InChI=1S/C11H7F3N2/c12-11(13,14)10-7-9(3-6-16-10)8-1-4-15-5-2-8/h1-7H
SMILES FC(c1nccc(c1)c1ccncc1)(F)F
InChI Key YIYSYLUFLWDJHV-UHFFFAOYSA-N
Exact Mass 224.182 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/YIYSYLUFLWDJHV-UHFFFAOYSA-N/CHMO0000591
License URL
Source https://www.chemotion-repository.net/inchikey/YIYSYLUFLWDJHV-UHFFFAOYSA-N/CHMO0000591
Version
Author Hannes Kühner
Maintainer Chemotion Repository
Language english
MetadataPublished 2025-03-17
Related Molecule
  • 4-pyridin-4-yl-2-(trifluoromethyl)pyridine
    • Field Value
    Measurement Technique nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    152528155 PubChem
    The data in this table is sourced from UniChem at EBI.