Dataset

infrared absorption spectroscopy (IR)

dataset for infrared absorption spectroscopy (IR)

Chemical Information

molecular Image
InChI InChI=1S/C14H15N/c1-11-8-9-12(2)14(10-11)15-13-6-4-3-5-7-13/h3-10,15H,1-2H3
SMILES Cc1ccc(c(c1)Nc1ccccc1)C
InChI Key QCIPGRGZZUTJAG-UHFFFAOYSA-N
Molecular Formula C14H15N
Exact Mass 197.276 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/QCIPGRGZZUTJAG-UHFFFAOYSA-N/CHMO0000630
License URL
Source https://www.chemotion-repository.net/inchikey/QCIPGRGZZUTJAG-UHFFFAOYSA-N/CHMO0000630
Version
Author Eduard Spuling
Maintainer Chemotion Repository
Language english
MetadataPublished 2020-10-05
Related Molecule
  • 2,5-dimethyl-N-phenylaniline
    • Field Value
    Measurement Technique infrared absorption spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    8691617 surechembl
    10899586 pubchem
    DTXSID80447651 comptox
    The data in this table is sourced from UniChem at EBI.