Dataset

mass spectrometry (MS)

dataset for mass spectrometry (MS)

Chemical Information

molecular Image
InChI InChI=1S/C12H14BrNO3S/c13-12-4-2-1-3-11(12)5-10-18(15,16)14-6-8-17-9-7-14/h1-5,10H,6-9H2/b10-5+
SMILES Brc1ccccc1/C=C/S(=O)(=O)N1CCOCC1
InChI Key OBDSTLGDPFJPFI-BJMVGYQFSA-N
Exact Mass 332.213 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/OBDSTLGDPFJPFI-BJMVGYQFSA-N/CHMO0000470
License URL
Source https://www.chemotion-repository.net/inchikey/OBDSTLGDPFJPFI-BJMVGYQFSA-N/CHMO0000470
Version
Author Georg Manolikakes
Maintainer Chemotion Repository
Language english
MetadataPublished 2025-08-14
Related Molecule
  • 4-[(E)-2-(2-bromophenyl)ethenyl]sulfonylmorpholine
    • Field Value
    Measurement Technique mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    No additional information available for this Dataset.