Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR)

Chemical Information

molecular Image
InChI InChI=1S/C14H8F4N2/c15-11-4-2-1-3-10(11)12-8-20-7-9(14(16,17)18)5-6-13(20)19-12/h1-8H
SMILES Fc1ccccc1c1cn2c(n1)ccc(c2)C(F)(F)F
InChI Key SEADNLGNBQIQGS-UHFFFAOYSA-N
Molecular Formula C14H8F4N2
Exact Mass 280.220 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/SEADNLGNBQIQGS-UHFFFAOYSA-N/CHMO0000595
License URL
Source https://www.chemotion-repository.net/inchikey/SEADNLGNBQIQGS-UHFFFAOYSA-N/CHMO0000595
Version
Author Simone Gräßle
Maintainer Chemotion Repository
Language english
MetadataPublished 2023-03-03
Related Molecule
  • 2-(2-fluorophenyl)-6-(trifluoromethyl)imidazo[1,2-a]pyridine
    • Field Value
    Measurement Technique 13C nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    166638642 PubChem
    The data in this table is sourced from UniChem at EBI.