Dataset

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

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

Chemical Information

molecular Image
InChI InChI=1S/C19H20N4O2/c1-11(2)20-18-13-10-15(25-4)14(24-3)9-12(13)17-19(22-18)23-8-6-5-7-16(23)21-17/h5-11H,1-4H3,(H,20,22)
SMILES COc1cc2c(NC(C)C)nc3c(c2cc1OC)nc1n3cccc1
InChI Key VJUXHPAAXFEYKZ-UHFFFAOYSA-N
Molecular Formula C19H20N4O2
Exact Mass 336.388 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/VJUXHPAAXFEYKZ-UHFFFAOYSA-N/CHMO0001150
License URL
Source https://www.chemotion-repository.net/inchikey/VJUXHPAAXFEYKZ-UHFFFAOYSA-N/CHMO0001150
Version
Author Mareen Stahlberger
Maintainer Chemotion Repository
Language english
MetadataPublished 2023-01-23
Related Molecule
  • 4,5-dimethoxy-N-propan-2-yl-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
    166451855 PubChem
    The data in this table is sourced from UniChem at EBI.