Dataset

mass spectrometry (MS)

dataset for mass spectrometry (MS)

Chemical Information

molecular Image
InChI InChI=1S/C10H10N2/c1-7-8(2)12-10-6-4-3-5-9(10)11-7/h3-6H,1-2H3
SMILES Cc1nc2ccccc2nc1C
InChI Key FKHNZQFCDGOQGV-UHFFFAOYSA-N
Molecular Formula C10H10N2
Exact Mass 158.200 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/FKHNZQFCDGOQGV-UHFFFAOYSA-N/CHMO0000470.2
License URL
Source https://www.chemotion-repository.net/inchikey/FKHNZQFCDGOQGV-UHFFFAOYSA-N/CHMO0000470.2
Version
Author Victor Larignon
Maintainer Chemotion Repository
Language english
MetadataPublished 2021-05-13
Related Molecule
  • 2,3-dimethylquinoxaline
    • Field Value
    Measurement Technique mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEBI:132810 chebi
    CHEMBL67865 chembl
    103601 surechembl
    29364974 surechembl
    16925 pubchem
    4K2NH2OBE9 fdasrs
    KEYNOR CCDC
    Molport-000-703-080 molport
    The data in this table is sourced from UniChem at EBI.