Dataset

distortionless enhancement with polarization transfer (DEPT)

dataset for distortionless enhancement with polarization transfer (DEPT)

Chemical Information

molecular Image
InChI InChI=1S/C14H8ClF3N2/c15-11-6-10(14(16,17)18)7-20-8-12(19-13(11)20)9-4-2-1-3-5-9/h1-8H
SMILES Clc1cc(cn2c1nc(c2)c1ccccc1)C(F)(F)F
InChI Key ATHNSQRFCXRPMB-UHFFFAOYSA-N
Molecular Formula C14H8ClF3N2
Exact Mass 296.675 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/ATHNSQRFCXRPMB-UHFFFAOYSA-N/CHMO0000596
License URL
Source https://www.chemotion-repository.net/inchikey/ATHNSQRFCXRPMB-UHFFFAOYSA-N/CHMO0000596
Version
Author Simone Gräßle
Maintainer Chemotion Repository
Language english
MetadataPublished 2023-03-03
Related Molecule
  • 8-chloro-2-phenyl-6-(trifluoromethyl)imidazo[1,2-a]pyridine
    • Field Value
    Measurement Technique distortionless enhancement with polarization transfer
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEMBL1376360 ChEMBL
    ZINC000000074217 ZINC
    49504 BindingDB
    2725829 PubChem
    4885758 eMolecules
    MCULE-1695671424 Mcule
    The data in this table is sourced from UniChem at EBI.