Dataset

19F nuclear magnetic resonance spectroscopy (19F NMR)

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

Chemical Info

molecular Image
InChI InChI=1S/C29H30FN3/c1-28(2,3)22-13-7-19(8-14-22)25-31-26(20-9-15-23(16-10-20)29(4,5)6)33-27(32-25)21-11-17-24(30)18-12-21/h7-18H,1-6H3
SMILES Fc1ccc(cc1)c1nc(nc(n1)c1ccc(cc1)C(C)(C)C)c1ccc(cc1)C(C)(C)C
InChI Key HTKZMQNHDRKIHZ-UHFFFAOYSA-N
Molecular Formula C29H30FN3
Exact Mass 439.567 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/HTKZMQNHDRKIHZ-UHFFFAOYSA-N/CHMO0000597
License URL
Source https://www.chemotion-repository.net/inchikey/HTKZMQNHDRKIHZ-UHFFFAOYSA-N/CHMO0000597
Version
Author Zhen Zhang
Maintainer Chemotion Repository
Language english
MetadataPublished 2020-10-05
Related Molecule
  • 2,4-bis(4-tert-butylphenyl)-6-(4-fluorophenyl)-1,3,5-triazine
    • Field Value
    Measurement Technique 19F nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    154701152 PubChem
    The data in this table is sourced from UniChem at EBI.