Dataset

distortionless enhancement with polarization transfer (DEPT)

dataset for distortionless enhancement with polarization transfer (DEPT)

Chemical Information

molecular Image
InChI InChI=1S/C4H7BrO2/c1-7-4(6)2-3-5/h2-3H2,1H3
SMILES COC(=O)CCBr
InChI Key KQEVIFKPZOGBMZ-UHFFFAOYSA-N
Exact Mass 167.001 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/KQEVIFKPZOGBMZ-UHFFFAOYSA-N/CHMO0000596
License URL
Source https://www.chemotion-repository.net/inchikey/KQEVIFKPZOGBMZ-UHFFFAOYSA-N/CHMO0000596
Version
Author Jana Alpin
Maintainer Chemotion Repository
Language english
MetadataPublished 2024-02-20
Related Molecule
  • methyl 3-bromopropanoate
    • Field Value
    Measurement Technique distortionless enhancement with polarization transfer
    Measurement Variables
    Title : CCP-3670

    Date : 20240126

    Start time : 18.34 h

    Label : JAL-2

    ID : 111229

    Solvent : chloroform-D1 (CDCl3)

    Temperature : 300.0 K K

    Puls programme : deptsp90

    Number of scans : 256

    Instrument : spect

    Data-Source Molecule ID Data-Source
    28699 surechembl
    76934 pubchem
    Y803CH1P4W fdasrs
    Molport-001-780-239 molport
    The data in this table is sourced from UniChem at EBI.