Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

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

Chemical Information

molecular Image
InChI InChI=1S/C6H4ClF3N2/c7-4-1-3(6(8,9)10)2-12-5(4)11/h1-2H,(H2,11,12)
SMILES Nc1ncc(cc1Cl)C(F)(F)F
InChI Key WXNPZQIRDCDLJD-UHFFFAOYSA-N
Molecular Formula C6H4ClF3N2
Exact Mass 196.558 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/WXNPZQIRDCDLJD-UHFFFAOYSA-N/CHMO0000595
License URL
Source https://www.chemotion-repository.net/inchikey/WXNPZQIRDCDLJD-UHFFFAOYSA-N/CHMO0000595
Version
Author Simone Gräßle
Maintainer Chemotion Repository
Language english
MetadataPublished 2025-01-08
Related Molecule
  • 3-chloro-5-(trifluoromethyl)pyridin-2-amine
    • Field Value
    Measurement Technique 13C nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    No additional information available for this Dataset.