Dataset

infrared absorption spectroscopy (IR)

dataset for infrared absorption spectroscopy (IR)

Chemical Information

molecular Image
InChI InChI=1S/C14H10N2/c1-2-6-11(7-3-1)14-10-15-12-8-4-5-9-13(12)16-14/h1-10H
SMILES c1ccc(cc1)c1cnc2c(n1)cccc2
InChI Key QWNCDHYYJATYOG-UHFFFAOYSA-N
Molecular Formula C14H10N2
Exact Mass 206.243 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/QWNCDHYYJATYOG-UHFFFAOYSA-N/CHMO0000630
License URL
Source https://www.chemotion-repository.net/inchikey/QWNCDHYYJATYOG-UHFFFAOYSA-N/CHMO0000630
Version
Author Laura Holzhauer
Maintainer Chemotion Repository
Language english
MetadataPublished 2025-03-16
Related Molecule
  • 2-phenylquinoxaline
    • Field Value
    Measurement Technique infrared absorption spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEMBL69695 chembl
    29371290 surechembl
    87505 surechembl
    78725 pubchem
    VAKHUK CCDC
    DTXSID50198244 comptox
    Molport-001-014-341 molport
    The data in this table is sourced from UniChem at EBI.