Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR)

Chemical Information

molecular Image
InChI InChI=1S/C19H18N6O/c1-24(2)14-10-8-13(9-11-14)17-12-25(23-22-17)18-19(26-3)21-16-7-5-4-6-15(16)20-18/h4-12H,1-3H3
SMILES COc1nc2ccccc2nc1n1nnc(c1)c1ccc(cc1)N(C)C
InChI Key JFQSSXFWQBLAFL-UHFFFAOYSA-N
Exact Mass 346.386 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/JFQSSXFWQBLAFL-UHFFFAOYSA-N/CHMO0000595
License URL
Source https://www.chemotion-repository.net/inchikey/JFQSSXFWQBLAFL-UHFFFAOYSA-N/CHMO0000595
Version
Author Laura Holzhauer
Maintainer Chemotion Repository
Language english
MetadataPublished 2025-03-16
Related Molecule
  • 4-[1-(3-methoxyquinoxalin-2-yl)triazol-4-yl]-N,N-dimethylaniline
    • Field Value
    Measurement Technique 13C nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    172877802 pubchem
    The data in this table is sourced from UniChem at EBI.