Dataset

infrared absorption spectroscopy (IR)

dataset for infrared absorption spectroscopy (IR)

Chemical Information

molecular Image
InChI InChI=1S/C20H20O2/c1-14(20(21)22-2)19-13-17-8-7-15-3-5-16(6-4-15)9-11-18(19)12-10-17/h3-6,10,12-13H,1,7-9,11H2,2H3
SMILES COC(=O)C(=C)c1cc2ccc1CCc1ccc(CC2)cc1
InChI Key RDUGGFZJQYGUDC-UHFFFAOYSA-N
Molecular Formula C20H20O2
Exact Mass 292.372 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/RDUGGFZJQYGUDC-UHFFFAOYSA-N/CHMO0000630
License URL
Source https://www.chemotion-repository.net/inchikey/RDUGGFZJQYGUDC-UHFFFAOYSA-N/CHMO0000630
Version
Author Christoph Zippel
Maintainer Chemotion Repository
Language english
MetadataPublished 2021-11-19
Related Molecule
  • methyl 2-(5-tricyclo[8.2.2.24,7]hexadeca-1(13),4,6,10(14),11,15-hexaenyl)prop-2-enoate
    • Field Value
    Measurement Technique infrared absorption spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    157010720 PubChem
    The data in this table is sourced from UniChem at EBI.