Dataset

infrared absorption spectroscopy (IR)

dataset for infrared absorption spectroscopy (IR)

Chemical Information

molecular Image
InChI InChI=1S/C24H28O3/c1-5-6-7-8-18-11-22(25)21-14-19(24(26)27-23(21)12-18)13-20-16(3)9-15(2)10-17(20)4/h9-12,14,25H,5-8,13H2,1-4H3
SMILES CCCCCc1cc(O)c2c(c1)oc(=O)c(c2)Cc1c(C)cc(cc1C)C
InChI Key RZNJPIOGJGUFNS-UHFFFAOYSA-N
Molecular Formula C24H28O3
Exact Mass 364.477 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/RZNJPIOGJGUFNS-UHFFFAOYSA-N/IR
License URL
Source https://www.chemotion-repository.net/inchikey/RZNJPIOGJGUFNS-UHFFFAOYSA-N/IR
Version
Author Yu-Chieh Huang
Maintainer Chemotion Repository
Language english
MetadataPublished 2019-06-27
Related Molecule
  • 5-hydroxy-7-pentyl-3-[(2,4,6-trimethylphenyl)methyl]chromen-2-one
    • Field Value
    Measurement Technique infrared absorption spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    138453448 PubChem
    The data in this table is sourced from UniChem at EBI.