Dataset

infrared absorption spectroscopy (IR)

dataset for infrared absorption spectroscopy (IR)

Chemical Information

molecular Image
InChI InChI=1S/C19H14N6/c20-11-17-13-24(12-15-7-3-1-4-8-15)22-19(17)25-14-18(21-23-25)16-9-5-2-6-10-16/h1-10,13-14H,12H2
SMILES N#Cc1cn(nc1n1nnc(c1)c1ccccc1)Cc1ccccc1
InChI Key DGWASOOTEXXJBK-UHFFFAOYSA-N
Molecular Formula C19H14N6
Exact Mass 326.355 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/DGWASOOTEXXJBK-UHFFFAOYSA-N/CHMO0000630
License URL
Source https://www.chemotion-repository.net/inchikey/DGWASOOTEXXJBK-UHFFFAOYSA-N/CHMO0000630
Version
Author Nicolai Wippert
Maintainer Chemotion Repository
Language english
MetadataPublished 2024-02-14
Related Molecule
  • 1-benzyl-3-(4-phenyltriazol-1-yl)pyrazole-4-carbonitrile
    • Field Value
    Measurement Technique infrared absorption spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    No additional information available for this Dataset.