Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

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

Chemical Information

molecular Image
InChI InChI=1S/C14H11N3/c15-14-13(10-6-2-1-3-7-10)16-11-8-4-5-9-12(11)17-14/h1-9H,(H2,15,17)
SMILES Nc1nc2ccccc2nc1c1ccccc1
InChI Key ABTZHDQWMUXIFW-UHFFFAOYSA-N
Molecular Formula C14H11N3
Exact Mass 221.257 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/ABTZHDQWMUXIFW-UHFFFAOYSA-N/CHMO0000595
License URL
Source https://www.chemotion-repository.net/inchikey/ABTZHDQWMUXIFW-UHFFFAOYSA-N/CHMO0000595
Version
Author Laura Holzhauer
Maintainer Chemotion Repository
Language english
MetadataPublished 2025-03-16
Related Molecule
  • 3-phenylquinoxalin-2-amine
    • Field Value
    Measurement Technique 13C nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    384076 surechembl
    12231766 pubchem
    Molport-019-938-771 molport
    The data in this table is sourced from UniChem at EBI.