Dataset

infrared absorption spectroscopy (IR)

dataset for infrared absorption spectroscopy (IR)

Chemical Information

molecular Image
InChI InChI=1S/C14H12N4/c15-18-14-13(10-6-2-1-3-7-10)16-11-8-4-5-9-12(11)17-14/h1-9H,15H2,(H,17,18)
SMILES NNc1nc2ccccc2nc1c1ccccc1
InChI Key DUWZSLVPQIKYHU-UHFFFAOYSA-N
Molecular Formula C14H12N4
Exact Mass 236.272 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/DUWZSLVPQIKYHU-UHFFFAOYSA-N/CHMO0000630.1
License URL
Source https://www.chemotion-repository.net/inchikey/DUWZSLVPQIKYHU-UHFFFAOYSA-N/CHMO0000630.1
Version
Author Jérôme Klein
Maintainer Chemotion Repository
Language english
MetadataPublished 2021-10-10
Related Molecule
  • (3-phenylquinoxalin-2-yl)hydrazine
    • Field Value
    Measurement Technique infrared absorption spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    804284 pubchem
    The data in this table is sourced from UniChem at EBI.