Dataset

distortionless enhancement with polarization transfer (DEPT)

dataset for distortionless enhancement with polarization transfer (DEPT)

Chemical Information

molecular Image
InChI InChI=1S/C7H9NO/c8-5-6-2-1-3-7(9)4-6/h1-4,9H,5,8H2
SMILES NCc1cccc(c1)O
InChI Key JNZYADHPGVZMQK-UHFFFAOYSA-N
Exact Mass 123.152 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/JNZYADHPGVZMQK-UHFFFAOYSA-N/CHMO0000596.1
License URL
Source https://www.chemotion-repository.net/inchikey/JNZYADHPGVZMQK-UHFFFAOYSA-N/CHMO0000596.1
Version
Author Jana Alpin
Maintainer Chemotion Repository
Language english
MetadataPublished 2024-07-01
Related Molecule
  • 3-(aminomethyl)phenol
    • Field Value
    Measurement Technique distortionless enhancement with polarization transfer
    Measurement Variables
    Title : CCP-3703 DMSO

    Date : 20240608

    Start time : 12.15 h

    Label : JAL-46

    ID : 118090

    Solvent : DMSO

    Temperature : 300.0 K K

    Puls programme : deptsp90

    Number of scans : 256

    Instrument : spect

    Data-Source Molecule ID Data-Source
    CHEBI:125604 chebi
    CHEMBL4069065 chembl
    138953 surechembl
    29598265 surechembl
    735894 pubchem
    PD206984 probes_and_drugs
    Molport-000-159-446 molport
    50266949 bindingdb
    The data in this table is sourced from UniChem at EBI.