Dataset

distortionless enhancement with polarization transfer (DEPT)

dataset for distortionless enhancement with polarization transfer (DEPT)

Chemical Information

molecular Image
InChI InChI=1S/C6H5N3/c7-4-5-1-2-9-6(8)3-5/h1-3H,(H2,8,9)
SMILES N#Cc1ccnc(c1)N
InChI Key GEEAYLFEIFJFGP-UHFFFAOYSA-N
Exact Mass 119.124 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/GEEAYLFEIFJFGP-UHFFFAOYSA-N/CHMO0000596
License URL
Source https://www.chemotion-repository.net/inchikey/GEEAYLFEIFJFGP-UHFFFAOYSA-N/CHMO0000596
Version
Author Simone Gräßle
Maintainer Chemotion Repository
Language english
MetadataPublished 2026-03-30
Related Molecule
  • 2-aminopyridine-4-carbonitrile
    • Field Value
    Measurement Technique distortionless enhancement with polarization transfer
    Measurement Variables
    Date : 2026-02-07

    Start time : 00:16:36 UTC

    Creator : Simone Gräßle

    Solvent : DMSO

    Temperature : 299.9991 K K

    Puls programme : deptsp135

    Number of scans : 256

    Instrument : spect

    Name : TopSpin

    Data-Source Molecule ID Data-Source
    312451 surechembl
    31294130 surechembl
    7015524 pubchem
    DTXSID40426745 comptox
    Molport-000-001-278 molport
    The data in this table is sourced from UniChem at EBI.