Dataset

infrared absorption spectroscopy (IR)

dataset for infrared absorption spectroscopy (IR)

Chemical Information

molecular Image
InChI InChI=1S/C11H13NO3/c13-6-9(14)7-15-10-2-1-8-3-4-12-11(8)5-10/h1-5,9,12-14H,6-7H2
SMILES OCC(COc1ccc2c(c1)[nH]cc2)O
InChI Key LGLOUTXCZFMZQQ-UHFFFAOYSA-N
Molecular Formula C11H13NO3
Exact Mass 207.226 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/LGLOUTXCZFMZQQ-UHFFFAOYSA-N/CHMO0000630
License URL
Source https://www.chemotion-repository.net/inchikey/LGLOUTXCZFMZQQ-UHFFFAOYSA-N/CHMO0000630
Version
Author Niklas Krappel
Maintainer Chemotion Repository
Language english
MetadataPublished 2025-05-22
Related Molecule
  • 3-(1H-indol-6-yloxy)propane-1,2-diol
    • Field Value
    Measurement Technique infrared absorption spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    No additional information available for this Dataset.