Dataset

infrared absorption spectroscopy (IR)

dataset for infrared absorption spectroscopy (IR)

Chemical Information

molecular Image
InChI InChI=1S/C23H22N2OS2/c1-3-8-18(9-4-1)22(23-27-16-7-17-28-23)25-24-19-12-14-21(15-13-19)26-20-10-5-2-6-11-20/h1-6,8-15,23-24H,7,16-17H2/b25-22+
SMILES c1ccc(cc1)Oc1ccc(cc1)N/N=C(\c1ccccc1)/C1SCCCS1
InChI Key PBTUVUQCTONFGS-YYDJUVGSSA-N
Molecular Formula C23H22N2OS2
Exact Mass 406.564 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/PBTUVUQCTONFGS-YYDJUVGSSA-N/IR
License URL
Source https://www.chemotion-repository.net/inchikey/PBTUVUQCTONFGS-YYDJUVGSSA-N/IR
Version
Author Bettina Stanek
Maintainer Chemotion Repository
Language english
MetadataPublished 2014-05-27
Related Molecule
  • N-[(E)-[1,3-dithian-2-yl(phenyl)methylidene]amino]-4-phenoxyaniline
    • Field Value
    Measurement Technique infrared absorption spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    73427472 PubChem
    The data in this table is sourced from UniChem at EBI.