Dataset

19F nuclear magnetic resonance spectroscopy (19F NMR)

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

Chemical Information

molecular Image
InChI InChI=1S/C23H16F3NO/c24-23(25,26)22(28)27(17-19-11-5-2-6-12-19)21-14-8-7-13-20(21)16-15-18-9-3-1-4-10-18/h1-14H,17H2
SMILES O=C(C(F)(F)F)N(c1ccccc1C#Cc1ccccc1)Cc1ccccc1
InChI Key VVAQNEJUGPEHSI-UHFFFAOYSA-N
Molecular Formula C23H16F3NO
Exact Mass 379.374 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/VVAQNEJUGPEHSI-UHFFFAOYSA-N/CHMO0000597
License URL
Source https://www.chemotion-repository.net/inchikey/VVAQNEJUGPEHSI-UHFFFAOYSA-N/CHMO0000597
Version
Author Helena Šimek
Maintainer Chemotion Repository
Language english
MetadataPublished 2022-09-15
Related Molecule
  • N-benzyl-2,2,2-trifluoro-N-[2-(2-phenylethynyl)phenyl]acetamide
    • Field Value
    Measurement Technique 19F nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    101026077 pubchem
    The data in this table is sourced from UniChem at EBI.