Dataset

distortionless enhancement with polarization transfer (DEPT)

dataset for distortionless enhancement with polarization transfer (DEPT)

Chemical Information

molecular Image
InChI InChI=1S/C22H24P.BrH/c1-2-3-19-23(20-13-7-4-8-14-20,21-15-9-5-10-16-21)22-17-11-6-12-18-22;/h4-18H,2-3,19H2,1H3;1H/q+1;/p-1
SMILES CCCC[P+](c1ccccc1)(c1ccccc1)c1ccccc1.[Br-]
InChI Key IKWKJIWDLVYZIY-UHFFFAOYSA-M
Exact Mass 399.304 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/IKWKJIWDLVYZIY-UHFFFAOYSA-M/CHMO0000596
License URL
Source https://www.chemotion-repository.net/inchikey/IKWKJIWDLVYZIY-UHFFFAOYSA-M/CHMO0000596
Version
Author Jana Barylko
Maintainer Chemotion Repository
Language english
MetadataPublished 2026-05-13T08:24:59Z
Related Molecule
  • butyl(triphenyl)phosphanium;bromide
    • Field Value
    Measurement Technique distortionless enhancement with polarization transfer
    Measurement Variables
    Title : JBA-CCP-3740

    Date : 20240604

    Start time : 4.07 h

    Label : JBA-8

    ID : 119357

    Solvent : chloroform-D1 (CDCl3)

    Temperature : 300.0 K K

    Puls programme : deptsp90

    Number of scans : 256

    Instrument : spect

    Data-Source Molecule ID Data-Source
    CHEMBL4792223 chembl
    1063 surechembl
    159628 pubchem
    97KU95HRS8 fdasrs
    DTXSID90883581 comptox
    The data in this table is sourced from UniChem at EBI.