Dataset

distortionless enhancement with polarization transfer (DEPT)

dataset for distortionless enhancement with polarization transfer (DEPT)

Chemical Information

molecular Image
InChI InChI=1S/C3H4Cl2O/c4-1-3(6)2-5/h1-2H2
SMILES ClCC(=O)CCl
InChI Key SUNMBRGCANLOEG-UHFFFAOYSA-N
Molecular Formula C3H4Cl2O
Exact Mass 126.969 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/SUNMBRGCANLOEG-UHFFFAOYSA-N/CHMO0000596
License URL
Source https://www.chemotion-repository.net/inchikey/SUNMBRGCANLOEG-UHFFFAOYSA-N/CHMO0000596
Version
Author Jana Alpin
Maintainer Chemotion Repository
Language english
MetadataPublished 2024-04-09
Related Molecule
  • 1,3-dichloropropan-2-one
    • Field Value
    Measurement Technique distortionless enhancement with polarization transfer
    Measurement Variables
    Title : CCP-3705

    Date : 20240219

    Start time : 15.01 h

    Label : CCP-3535

    ID : 293506

    Solvent : chloroform-D1 (CDCl3)

    Temperature : 300.0 K K

    Puls programme : deptsp90

    Number of scans : 256

    Instrument : spect

    Data-Source Molecule ID Data-Source
    CHEBI:156485 chebi
    CHM rcsb_pdb
    CHEMBL1231783 chembl
    30570 surechembl
    10793 pubchem
    UFH8559WS5 fdasrs
    PD194063 probes_and_drugs
    DCACON CCDC
    47695 brenda
    HMDB0244164 hmdb
    Molport-001-766-690 molport
    The data in this table is sourced from UniChem at EBI.