Dataset

1,2-Benzisothiazolinone; LC-ESI-ITFT; MS2; CE: 70%; R=15000; [M+H]+

This MassBank record with Accession MSBNK-UFZ-WANA0200213166PH contains the MS2 mass spectrum of 1,2-Benzisothiazolinone with the InChIkey DMSMPAJRVJJAGA-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C7H5NOS/c9-7-5-3-1-2-4-6(5)10-8-7/h1-4H,(H,8,9)
SMILES O=C1NSC2=CC=CC=C12
InChI Key DMSMPAJRVJJAGA-UHFFFAOYSA-N
Molecular Formula C7H5NOS
Exact Mass 151.009 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-UFZ-WANA0200213166PH
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MetadataPublished 2023-08-13
Related Molecule
  • 1,2-benzothiazol-3-one
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    No additional information available for this Dataset.