Dataset

infrared absorption spectroscopy (IR)

dataset for infrared absorption spectroscopy (IR)

Chemical Information

molecular Image
InChI InChI=1S/C15H18O/c16-15(14-11-7-4-8-12-14)13-9-5-2-1-3-6-10-13/h1-2,4,7-8,10-12,15-16H,3,5-6,9H2/b2-1-,13-10+
SMILES OC(c1ccccc1)C1=CCCC=CCC1
InChI Key YEXSQZVKKLPKME-ROPMGSPZSA-N
Molecular Formula C15H18O
Exact Mass 214.303 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/YEXSQZVKKLPKME-ROPMGSPZSA-N/IR
License URL
Source https://www.chemotion-repository.net/inchikey/YEXSQZVKKLPKME-ROPMGSPZSA-N/IR
Version
Author Yu-Chieh Huang
Maintainer Chemotion Repository
Language english
MetadataPublished 2019-06-27
Related Molecule
  • [(1E,5Z)-cycloocta-1,5-dien-1-yl]-phenylmethanol
    • Field Value
    Measurement Technique infrared absorption spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    138453786 PubChem
    The data in this table is sourced from UniChem at EBI.