Dataset

infrared absorption spectroscopy (IR)

dataset for infrared absorption spectroscopy (IR)

Chemical Information

molecular Image
InChI InChI=1S/C20H20N2O2/c23-15(12-21-13-16-6-5-11-24-16)14-22-19-9-3-1-7-17(19)18-8-2-4-10-20(18)22/h1-11,15,21,23H,12-14H2
SMILES OC(Cn1c2ccccc2c2c1cccc2)CNCc1ccco1
InChI Key PWDXMUGOYSJNDS-UHFFFAOYSA-N
Molecular Formula C20H20N2O2
Exact Mass 320.385 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/PWDXMUGOYSJNDS-UHFFFAOYSA-N/IR
License URL
Source https://www.chemotion-repository.net/inchikey/PWDXMUGOYSJNDS-UHFFFAOYSA-N/IR
Version
Author Simone Gräßle
Maintainer Chemotion Repository
Language english
MetadataPublished 2014-05-27
Related Molecule
  • 1-carbazol-9-yl-3-(furan-2-ylmethylamino)propan-2-ol
    • Field Value
    Measurement Technique infrared absorption spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEMBL1342330 ChEMBL
    MCULE-7731455720 Mcule
    1056392 eMolecules
    SCHEMBL15380477 SureChEMBL
    652652 PubChem
    The data in this table is sourced from UniChem at EBI.