Dataset

distortionless enhancement with polarization transfer (DEPT)

dataset for distortionless enhancement with polarization transfer (DEPT)

Chemical Information

molecular Image
InChI InChI=1S/C10H11F3N2O2.BrH/c1-7(16)17-5-4-15-6-8(10(11,12)13)2-3-9(15)14;/h2-3,6,14H,4-5H2,1H3;1H
SMILES CC(=O)OCCn1cc(ccc1=N)C(F)(F)F.Br
InChI Key AYMMSXLTCOEJOX-UHFFFAOYSA-N
Molecular Formula C10H12BrF3N2O2
Exact Mass 329.114 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/AYMMSXLTCOEJOX-UHFFFAOYSA-N/CHMO0000596
License URL
Source https://www.chemotion-repository.net/inchikey/AYMMSXLTCOEJOX-UHFFFAOYSA-N/CHMO0000596
Version
Author Simone Gräßle
Maintainer Chemotion Repository
Language english
MetadataPublished 2023-02-09
Related Molecule
  • 2-[2-imino-5-(trifluoromethyl)pyridin-1-yl]ethyl acetate;hydrobromide
    • Field Value
    Measurement Technique distortionless enhancement with polarization transfer
    Measurement Variables
    Data-Source Molecule ID Data-Source
    SCHEMBL16648412 SureChEMBL
    118020257 PubChem
    The data in this table is sourced from UniChem at EBI.