Dataset

mass spectrometry (MS)

dataset for mass spectrometry (MS)

Chemical Information

molecular Image
InChI InChI=1S/C15H10N2O/c18-10-14-15(11-6-2-1-3-7-11)17-13-9-5-4-8-12(13)16-14/h1-10H
SMILES O=Cc1nc2ccccc2nc1c1ccccc1
InChI Key OHHQMUAHXRNAFQ-UHFFFAOYSA-N
Molecular Formula C15H10N2O
Exact Mass 234.253 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/OHHQMUAHXRNAFQ-UHFFFAOYSA-N/CHMO0000470
License URL
Source https://www.chemotion-repository.net/inchikey/OHHQMUAHXRNAFQ-UHFFFAOYSA-N/CHMO0000470
Version
Author Jérôme Klein
Maintainer Chemotion Repository
Language english
MetadataPublished 2020-04-18
Related Molecule
  • 3-phenylquinoxaline-2-carbaldehyde
    • Field Value
    Measurement Technique mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    12542557 PubChem
    163559909 PubChem: Thomson Pharma
    J1.418.743J Nikkaji
    The data in this table is sourced from UniChem at EBI.