Dataset

19F nuclear magnetic resonance spectroscopy (19F NMR)

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

Chemical Information

molecular Image
InChI InChI=1S/C22H10F6N2/c23-21(24,25)15-5-1-13(2-6-15)17-9-10-18(20(12-30)19(17)11-29)14-3-7-16(8-4-14)22(26,27)28/h1-10H
SMILES N#Cc1c(C#N)c(ccc1c1ccc(cc1)C(F)(F)F)c1ccc(cc1)C(F)(F)F
InChI Key BNARFEOZLAWZRF-UHFFFAOYSA-N
Molecular Formula C22H10F6N2
Exact Mass 416.319 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/BNARFEOZLAWZRF-UHFFFAOYSA-N/CHMO0000597
License URL
Source https://www.chemotion-repository.net/inchikey/BNARFEOZLAWZRF-UHFFFAOYSA-N/CHMO0000597
Version
Author Lukas Langer
Maintainer Chemotion Repository
Language english
MetadataPublished 2025-03-07
Related Molecule
  • 3,6-bis[4-(trifluoromethyl)phenyl]benzene-1,2-dicarbonitrile
    • Field Value
    Measurement Technique 19F nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    No additional information available for this Dataset.