Dataset

1H--1H correlation spectroscopy (1H-1H COSY)

dataset for 1H--1H correlation spectroscopy (1H-1H COSY)

Chemical Information

molecular Image
InChI InChI=1S/C20H22N4O2/c1-20(2,3)23-18-13-11-15(26-5)14(25-4)10-12(13)17-19(22-18)24-9-7-6-8-16(24)21-17/h6-11H,1-5H3,(H,22,23)
SMILES COc1cc2c(nc3c(c2cc1OC)nc1n3cccc1)NC(C)(C)C
InChI Key RGRCDEZDHRBRJV-UHFFFAOYSA-N
Molecular Formula C20H22N4O2
Exact Mass 350.414 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/RGRCDEZDHRBRJV-UHFFFAOYSA-N/CHMO0001150.1
License URL
Source https://www.chemotion-repository.net/inchikey/RGRCDEZDHRBRJV-UHFFFAOYSA-N/CHMO0001150.1
Version
Author Mareen Stahlberger
Maintainer Chemotion Repository
Language english
MetadataPublished 2023-01-23
Related Molecule
  • N-tert-butyl-4,5-dimethoxy-9,11,17-triazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,12,14,16-octaen-8-amine
    • Field Value
    Measurement Technique 1H–1H correlation spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    166451853 PubChem
    The data in this table is sourced from UniChem at EBI.