Dataset

infrared absorption spectroscopy (IR)

dataset for infrared absorption spectroscopy (IR)

Chemical Information

molecular Image
InChI InChI=1S/C17H10F3N3/c18-17(19,20)15-16-21-10-14(11-6-2-1-3-7-11)23(16)13-9-5-4-8-12(13)22-15/h1-10H
SMILES FC(c1nc2ccccc2n2c1ncc2c1ccccc1)(F)F
InChI Key VQYHDOFNDCKODK-UHFFFAOYSA-N
Molecular Formula C17H10F3N3
Exact Mass 313.277 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/VQYHDOFNDCKODK-UHFFFAOYSA-N/CHMO0000630
License URL
Source https://www.chemotion-repository.net/inchikey/VQYHDOFNDCKODK-UHFFFAOYSA-N/CHMO0000630
Version
Author Laura Holzhauer
Maintainer Chemotion Repository
Language english
MetadataPublished 2022-05-21
Related Molecule
  • 1-phenyl-4-(trifluoromethyl)imidazo[1,2-a]quinoxaline
    • Field Value
    Measurement Technique infrared absorption spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    163320731 PubChem
    The data in this table is sourced from UniChem at EBI.