Dataset

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

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

Chemical Information

molecular Image
InChI InChI=1S/C19H23N3O/c1-2-12-11-22-8-6-13(12)9-18(22)19(23)15-5-7-21-17-4-3-14(20)10-16(15)17/h2-5,7,10,12-13,18-19,23H,1,6,8-9,11,20H2/t12-,13-,18+,19-/m0/s1
SMILES C=C[C@H]1CN2CC[C@H]1C[C@@H]2[C@H](c1ccnc2c1cc(N)cc2)O
InChI Key PPQWXNWLIDJACB-WXPXUSHHSA-N
Molecular Formula C19H23N3O
Exact Mass 309.405 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/PPQWXNWLIDJACB-WXPXUSHHSA-N/CHMO0001150
License URL
Source https://www.chemotion-repository.net/inchikey/PPQWXNWLIDJACB-WXPXUSHHSA-N/CHMO0001150
Version
Author Johannes Liermann
Maintainer Chemotion Repository
Language english
MetadataPublished 2024-10-05
Related Molecule
  • (S)-(6-aminoquinolin-4-yl)-[(2R,4S,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]methanol
    • Field Value
    Measurement Technique 1H–1H correlation spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    168445338 PubChem
    The data in this table is sourced from UniChem at EBI.