Dataset

distortionless enhancement with polarization transfer (DEPT)

dataset for distortionless enhancement with polarization transfer (DEPT)

Chemical Information

molecular Image
InChI InChI=1S/C7H6O/c8-7-5-3-1-2-4-6-7/h1-6H
SMILES O=c1cccccc1
InChI Key QVWDCTQRORVHHT-UHFFFAOYSA-N
Exact Mass 106.122 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/QVWDCTQRORVHHT-UHFFFAOYSA-N/CHMO0000596
License URL
Source https://www.chemotion-repository.net/inchikey/QVWDCTQRORVHHT-UHFFFAOYSA-N/CHMO0000596
Version
Author Sylvia Vanderheiden-Schroen
Maintainer Chemotion Repository
Language english
MetadataPublished 2024-02-12
Related Molecule
  • cyclohepta-2,4,6-trien-1-one
    • Field Value
    Measurement Technique distortionless enhancement with polarization transfer
    Measurement Variables
    Title : SVS-3710

    Date : 20240208

    Start time : 14.43 h

    Label : CCP-3540

    ID : 294453

    Solvent : chloroform-D1 (CDCl3)

    Temperature : 300.0 K K

    Puls programme : deptsp135

    Number of scans : 256

    Instrument : spect

    Data-Source Molecule ID Data-Source
    492126 eMolecules
    CB8724528 ChemicalBook
    14769279 PubChem: Thomson Pharma
    SCHEMBL316824 SureChEMBL
    539-80-0 ACToR
    PD158365 ProbesDrugs
    32500 Brenda
    95275 Brenda
    MCULE-5628531135 Mcule
    CO48X7SUFH FDA SRS
    TROPON CCDC
    J99.871K Nikkaji
    ZINC000002034873 ZINC
    DTXSID60202169 EPA CompTox Dashboard
    10881 PubChem
    10015920 NMRShiftDB
    The data in this table is sourced from UniChem at EBI.