Dataset

1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)

dataset for 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)

Chemical Information

molecular Image
InChI InChI=1S/C19H22BrN3/c1-12-10-14(11-13(2)16(12)20)17-18(22-19(3,4)5)23-9-7-6-8-15(23)21-17/h6-11,22H,1-5H3
SMILES Cc1cc(cc(c1Br)C)c1nc2n(c1NC(C)(C)C)cccc2
InChI Key BPYJNKXACMKJPW-UHFFFAOYSA-N
Molecular Formula C19H22BrN3
Exact Mass 372.302 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/BPYJNKXACMKJPW-UHFFFAOYSA-N/CHMO0001148
License URL
Source https://www.chemotion-repository.net/inchikey/BPYJNKXACMKJPW-UHFFFAOYSA-N/CHMO0001148
Version
Author Mareen Stahlberger
Maintainer Chemotion Repository
Language english
MetadataPublished 2023-10-02
Related Molecule
  • 2-(4-bromo-3,5-dimethylphenyl)-N-tert-butylimidazo[1,2-a]pyridin-3-amine
    • Field Value
    Measurement Technique 1H–13C heteronuclear multiple bond coherence
    Measurement Variables
    Data-Source Molecule ID Data-Source
    168665440 PubChem
    The data in this table is sourced from UniChem at EBI.