Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

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

Chemical Information

molecular Image
InChI InChI=1S/C12H10N2O2/c1-7(15)11-12(8(2)16)14-10-6-4-3-5-9(10)13-11/h3-6H,1-2H3
SMILES CC(=O)c1nc2ccccc2nc1C(=O)C
InChI Key ZDVGFPIWQHQJLA-UHFFFAOYSA-N
Exact Mass 214.220 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/ZDVGFPIWQHQJLA-UHFFFAOYSA-N/CHMO0000595
License URL
Source https://www.chemotion-repository.net/inchikey/ZDVGFPIWQHQJLA-UHFFFAOYSA-N/CHMO0000595
Version
Author Laura Holzhauer
Maintainer Chemotion Repository
Language english
MetadataPublished 2025-03-16
Related Molecule
  • 1-(3-acetylquinoxalin-2-yl)ethanone
    • Field Value
    Measurement Technique 13C nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    14099196 surechembl
    13028874 pubchem
    The data in this table is sourced from UniChem at EBI.