Dataset

attenuated total reflectance Fourier transform infrared spectroscopy (ATR-FTIR)

dataset for attenuated total reflectance Fourier transform infrared spectroscopy (ATR-FTIR)

Chemical Information

molecular Image
InChI InChI=1S/C23H22N2O3S/c1-15(22(28-2)24-20(26)16-9-4-3-5-10-16)23(19-13-8-14-29-19)18-12-7-6-11-17(18)21(27)25-23/h3-15,22H,1-2H3,(H,24,26)(H,25,27)/t15-,22?,23+/m0/s1
SMILES COC([C@@H]([C@]1(NC(=O)c2c1cccc2)c1cccs1)C)NC(=O)c1ccccc1
InChI Key UQJQNVDXRZWZHJ-FOFKOLDFSA-N
Molecular Formula C23H22N2O3S
Exact Mass 406.497 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/UQJQNVDXRZWZHJ-FOFKOLDFSA-N/CHMO0000763.1
License URL
Source https://www.chemotion-repository.net/inchikey/UQJQNVDXRZWZHJ-FOFKOLDFSA-N/CHMO0000763.1
Version
Author Georg Manolikakes
Maintainer Chemotion Repository
Language english
MetadataPublished 2024-11-13
Related Molecule
  • N-[(2R)-1-methoxy-2-[(1R)-3-oxo-1-thiophen-2-yl-2H-isoindol-1-yl]propyl]benzamide
    • Field Value
    Measurement Technique attenuated total reflectance Fourier transform infrared spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    No additional information available for this Dataset.