Dataset

distortionless enhancement with polarization transfer (DEPT)

dataset for distortionless enhancement with polarization transfer (DEPT)

Chemical Information

molecular Image
InChI InChI=1S/C22H19NO2/c24-23(25)21-13-11-20(12-14-21)22-15-18-6-5-16-1-3-17(4-2-16)7-9-19(22)10-8-18/h1-4,8,10-15H,5-7,9H2
SMILES [O-][N+](=O)c1ccc(cc1)c1cc2CCc3ccc(CCc1cc2)cc3
InChI Key XRZQCHKTIVOMJE-UHFFFAOYSA-N
Molecular Formula C22H19NO2
Exact Mass 329.392 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/XRZQCHKTIVOMJE-UHFFFAOYSA-N/CHMO0000596.1
License URL
Source https://www.chemotion-repository.net/inchikey/XRZQCHKTIVOMJE-UHFFFAOYSA-N/CHMO0000596.1
Version
Author Tilman Hans Köhler
Maintainer Chemotion Repository
Language english
MetadataPublished 2024-05-21
Related Molecule
  • 5-(4-nitrophenyl)tricyclo[8.2.2.24,7]hexadeca-1(13),4,6,10(14),11,15-hexaene
    • Field Value
    Measurement Technique distortionless enhancement with polarization transfer
    Measurement Variables
    Title : Dec12-2023

    Date : 20231212

    Start time : 21.37 h

    Label : KT-588

    ID : 287740

    Solvent : chloroform-D1 (CDCl3)

    Temperature : 298.0 K K

    Puls programme : deptsp135

    Number of scans : 256

    Instrument : Avance NEO

    Data-Source Molecule ID Data-Source
    145707042 PubChem
    MIMDEV CCDC
    The data in this table is sourced from UniChem at EBI.