Dataset

distortionless enhancement with polarization transfer (DEPT)

dataset for distortionless enhancement with polarization transfer (DEPT)

Chemical Information

molecular Image
InChI InChI=1S/C10H9ClN2/c1-6-3-8-9(4-7(6)2)13-10(11)5-12-8/h3-5H,1-2H3
SMILES Clc1cnc2c(n1)cc(c(c2)C)C
InChI Key HGMIATOQJCNPOO-UHFFFAOYSA-N
Molecular Formula C10H9ClN2
Exact Mass 192.645 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/HGMIATOQJCNPOO-UHFFFAOYSA-N/CHMO0000596
License URL
Source https://www.chemotion-repository.net/inchikey/HGMIATOQJCNPOO-UHFFFAOYSA-N/CHMO0000596
Version
Author Jérôme Klein
Maintainer Chemotion Repository
Language english
MetadataPublished 2021-07-23
Related Molecule
  • 2-chloro-6,7-dimethylquinoxaline
    • Field Value
    Measurement Technique distortionless enhancement with polarization transfer
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEMBL1373137 ChEMBL
    ZINC000000344444 ZINC
    DTXSID20356511 EPA CompTox Dashboard
    74481 BindingDB
    MCULE-6875877052 Mcule
    825321 PubChem
    SCHEMBL6216217 SureChEMBL
    8199001 eMolecules
    The data in this table is sourced from UniChem at EBI.