Dataset

infrared absorption spectroscopy (IR)

dataset for infrared absorption spectroscopy (IR)

Chemical Information

molecular Image
InChI InChI=1S/C24H23IO4/c1-16-10-17(2)13-20(12-16)23(26)28-25(22-8-6-5-7-9-22)29-24(27)21-14-18(3)11-19(4)15-21/h5-15H,1-4H3
SMILES Cc1cc(C)cc(c1)C(=O)O[I](c1ccccc1)OC(=O)c1cc(C)cc(c1)C
InChI Key BDGLYIFQHWPHGI-UHFFFAOYSA-N
Molecular Formula C24H23IO4
Exact Mass 502.341 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/BDGLYIFQHWPHGI-UHFFFAOYSA-N/CHMO0000630
License URL
Source https://www.chemotion-repository.net/inchikey/BDGLYIFQHWPHGI-UHFFFAOYSA-N/CHMO0000630
Version
Author Vanessa Koch
Maintainer Chemotion Repository
Language english
MetadataPublished 2025-05-21
Related Molecule
  • [(3,5-dimethylbenzoyl)oxy-phenyl-lambda3-iodanyl] 3,5-dimethylbenzoate
    • Field Value
    Measurement Technique infrared absorption spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    138453685 pubchem
    The data in this table is sourced from UniChem at EBI.