Dataset

distortionless enhancement with polarization transfer (DEPT)

dataset for distortionless enhancement with polarization transfer (DEPT)

Chemical Information

molecular Image
InChI InChI=1S/C26H21BrN2O4/c1-15-24(14-27)29-23-13-21(17-6-10-19(11-7-17)26(31)33-3)20(12-22(23)28-15)16-4-8-18(9-5-16)25(30)32-2/h4-13H,14H2,1-3H3
SMILES COC(=O)c1ccc(cc1)c1cc2nc(CBr)c(nc2cc1c1ccc(cc1)C(=O)OC)C
InChI Key ZZMMSPYWOSXXGJ-UHFFFAOYSA-N
Molecular Formula C26H21BrN2O4
Exact Mass 505.360 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/ZZMMSPYWOSXXGJ-UHFFFAOYSA-N/CHMO0000596
License URL
Source https://www.chemotion-repository.net/inchikey/ZZMMSPYWOSXXGJ-UHFFFAOYSA-N/CHMO0000596
Version
Author Jérôme Klein
Maintainer Chemotion Repository
Language english
MetadataPublished 2022-04-17
Related Molecule
  • methyl 4-[2-(bromomethyl)-7-(4-methoxycarbonylphenyl)-3-methylquinoxalin-6-yl]benzoate
    • Field Value
    Measurement Technique distortionless enhancement with polarization transfer
    Measurement Variables
    Data-Source Molecule ID Data-Source
    163197213 PubChem
    The data in this table is sourced from UniChem at EBI.