Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

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

Chemical Information

molecular Image
InChI InChI=1S/C36H21F6N/c37-25-7-16-34(40)31(19-25)22-1-10-28(11-2-22)43(29-12-3-23(4-13-29)32-20-26(38)8-17-35(32)41)30-14-5-24(6-15-30)33-21-27(39)9-18-36(33)42/h1-21H
SMILES Fc1ccc(cc1c1ccc(cc1)N(c1ccc(cc1)c1cc(F)ccc1F)c1ccc(cc1)c1cc(F)ccc1F)F
InChI Key YUVGKANYCTZHML-UHFFFAOYSA-N
Molecular Formula C36H21F6N
Exact Mass 581.549 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/YUVGKANYCTZHML-UHFFFAOYSA-N/CHMO0000595
License URL
Source https://www.chemotion-repository.net/inchikey/YUVGKANYCTZHML-UHFFFAOYSA-N/CHMO0000595
Version
Author Ksenia Kutonova
Maintainer Chemotion Repository
Language english
MetadataPublished 2020-04-02
Related Molecule
  • 4-(2,5-difluorophenyl)-N,N-bis[4-(2,5-difluorophenyl)phenyl]aniline
    • Field Value
    Measurement Technique 13C nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    146018017 PubChem
    The data in this table is sourced from UniChem at EBI.