Dataset

19F nuclear magnetic resonance spectroscopy (19F NMR)

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

Chemical Information

molecular Image
InChI InChI=1S/C17H14F3N5S/c1-26-12-8-6-11(7-9-12)10-24-13-4-2-3-5-14(13)25-16(21-22-23-25)15(24)17(18,19)20/h2-9,15H,10H2,1H3
SMILES CSc1ccc(cc1)CN1c2ccccc2-n2c(C1C(F)(F)F)nnn2
InChI Key DHHRAEFWQYGCKX-UHFFFAOYSA-N
Exact Mass 377.387 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/DHHRAEFWQYGCKX-UHFFFAOYSA-N/CHMO0000597
License URL
Source https://www.chemotion-repository.net/inchikey/DHHRAEFWQYGCKX-UHFFFAOYSA-N/CHMO0000597
Version
Author Laura Holzhauer
Maintainer Chemotion Repository
Language english
MetadataPublished 2025-03-16
Related Molecule
  • 5-[(4-methylsulfanylphenyl)methyl]-4-(trifluoromethyl)-4H-tetrazolo[1,5-a]quinoxaline
    • Field Value
    Measurement Technique 19F nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    No additional information available for this Dataset.