Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

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

Chemical Information

molecular Image
InChI InChI=1S/C17H22N2O2/c1-2-3-4-5-6-9-12-21-17-16(13-20)18-14-10-7-8-11-15(14)19-17/h7-8,10-11,13H,2-6,9,12H2,1H3
SMILES CCCCCCCCOc1nc2ccccc2nc1C=O
InChI Key PIGGJTQWHRLBJO-UHFFFAOYSA-N
Molecular Formula C17H22N2O2
Exact Mass 286.369 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/PIGGJTQWHRLBJO-UHFFFAOYSA-N/CHMO0000595
License URL
Source https://www.chemotion-repository.net/inchikey/PIGGJTQWHRLBJO-UHFFFAOYSA-N/CHMO0000595
Version
Author Jérôme Klein
Maintainer Chemotion Repository
Language english
MetadataPublished 2022-04-17
Related Molecule
  • 3-octoxyquinoxaline-2-carbaldehyde
    • Field Value
    Measurement Technique 13C nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    163197222 pubchem
    The data in this table is sourced from UniChem at EBI.