Dataset

infrared absorption spectroscopy (IR)

dataset for infrared absorption spectroscopy (IR)

Chemical Information

molecular Image
InChI InChI=1S/C14H14N2O4S/c1-11-2-8-14(9-3-11)21(19,20)15-10-12-4-6-13(7-5-12)16(17)18/h2-9,15H,10H2,1H3
SMILES Cc1ccc(cc1)S(=O)(=O)NCc1ccc(cc1)[N+](=O)[O-]
InChI Key POBGMWYJYMNCHQ-UHFFFAOYSA-N
Molecular Formula C14H14N2O4S
Exact Mass 306.337 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/POBGMWYJYMNCHQ-UHFFFAOYSA-N/IR
License URL
Source https://www.chemotion-repository.net/inchikey/POBGMWYJYMNCHQ-UHFFFAOYSA-N/IR
Version
Author Tim Wezeman
Maintainer Chemotion Repository
Language english
MetadataPublished 2014-05-27
Related Molecule
  • 4-methyl-N-[(4-nitrophenyl)methyl]benzenesulfonamide
    • Field Value
    Measurement Technique infrared absorption spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    308626 pubchem
    The data in this table is sourced from UniChem at EBI.