Dataset

infrared absorption spectroscopy (IR)

dataset for infrared absorption spectroscopy (IR)

Chemical Information

molecular Image
InChI InChI=1S/C14H28O/c1-5-6-7-8-9-10-13-14(3,4)11-12(2)15-13/h12-13H,5-11H2,1-4H3
SMILES CCCCCCCC1OC(CC1(C)C)C
InChI Key JVUKDHVKYGPUFU-UHFFFAOYSA-N
Molecular Formula C14H28O
Exact Mass 212.372 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/JVUKDHVKYGPUFU-UHFFFAOYSA-N/CHMO0000630
License URL
Source https://www.chemotion-repository.net/inchikey/JVUKDHVKYGPUFU-UHFFFAOYSA-N/CHMO0000630
Version
Author Vanessa Koch
Maintainer Chemotion Repository
Language english
MetadataPublished 2025-05-21
Related Molecule
  • 2-heptyl-3,3,5-trimethyloxolane
    • Field Value
    Measurement Technique infrared absorption spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    No additional information available for this Dataset.