Dataset

distortionless enhancement with polarization transfer (DEPT)

dataset for distortionless enhancement with polarization transfer (DEPT)

Chemical Information

molecular Image
InChI InChI=1S/C20H23Br2N/c1-3-5-6-14(4-2)13-23-19-9-7-15(21)11-17(19)18-12-16(22)8-10-20(18)23/h7-12,14H,3-6,13H2,1-2H3
SMILES CCCCC(Cn1c2ccc(cc2c2c1ccc(c2)Br)Br)CC
InChI Key ZDFZWZGIGKUBRA-UHFFFAOYSA-N
Molecular Formula C20H23Br2N
Exact Mass 437.211 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/ZDFZWZGIGKUBRA-UHFFFAOYSA-N/CHMO0000596
License URL
Source https://www.chemotion-repository.net/inchikey/ZDFZWZGIGKUBRA-UHFFFAOYSA-N/CHMO0000596
Version
Author Henrik Tappert
Maintainer Chemotion Repository
Language english
MetadataPublished 2025-02-26
Related Molecule
  • 3,6-dibromo-9-(2-ethylhexyl)carbazole
    • Field Value
    Measurement Technique distortionless enhancement with polarization transfer
    Measurement Variables
    Title : Sep03-2024

    Date : 20240903

    Start time : 23.16 h

    Label : HT-304

    ID : 176728

    Solvent : CD2Cl2

    Temperature : 300.1 K K

    Puls programme : deptsp135

    Number of scans : 256

    Instrument : Avance NEO

    Data-Source Molecule ID Data-Source
    30978201 surechembl
    923358 surechembl
    16752909 pubchem
    Molport-027-837-257 molport
    The data in this table is sourced from UniChem at EBI.