Dataset

infrared absorption spectroscopy (IR)

dataset for infrared absorption spectroscopy (IR)

Chemical Information

molecular Image
InChI InChI=1S/C23H22/c1-2-4-20(5-3-1)16-23-17-21-11-10-18-6-8-19(9-7-18)12-14-22(23)15-13-21/h1-9,13,15,17H,10-12,14,16H2
SMILES c1ccc(cc1)Cc1cc2ccc1CCc1ccc(CC2)cc1
InChI Key BAEGRJPEJDSQTF-UHFFFAOYSA-N
Molecular Formula C23H22
Exact Mass 298.421 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/BAEGRJPEJDSQTF-UHFFFAOYSA-N/IR
License URL
Source https://www.chemotion-repository.net/inchikey/BAEGRJPEJDSQTF-UHFFFAOYSA-N/IR
Version
Author Yu-Chieh Huang
Maintainer Chemotion Repository
Language english
MetadataPublished 2019-06-27
Related Molecule
  • 5-benzyltricyclo[8.2.2.24,7]hexadeca-1(13),4,6,10(14),11,15-hexaene
    • Field Value
    Measurement Technique infrared absorption spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    138453518 pubchem
    The data in this table is sourced from UniChem at EBI.