Dataset

Saluamine; LC-ESI-QTOF; MS2; 10 V

This MassBank record with Accession MSBNK-BAFG-CSL2311095856 contains the MS2 mass spectrum of Saluamine with the InChIkey QQLJBZFXGDHSRU-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C7H7ClN2O4S/c8-4-2-5(9)3(7(11)12)1-6(4)15(10,13)14/h1-2H,9H2,(H,11,12)(H2,10,13,14)
SMILES Nc1cc(Cl)c(cc1C(O)=O)[S](N)(=O)=O
InChI Key QQLJBZFXGDHSRU-UHFFFAOYSA-N
Molecular Formula C7H7ClN2O4S
Exact Mass 249.982 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-BAFG-CSL2311095856
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Maintainer
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MetadataPublished 2023-11-09
Related Molecule
  • 2-amino-4-chloro-5-sulfamoylbenzoic acid
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    10433223 eMolecules
    76523 PubChem
    3086-91-7 ACToR
    CQE8131SF0 FDA SRS
    15391920 PubChem: Thomson Pharma
    SCHEMBL3040620 SureChEMBL
    DTXSID60184875 EPA CompTox Dashboard
    MCULE-7494137959 Mcule
    J217.252F Nikkaji
    HMDB0060761 Human Metabolome Database
    ZINC000005783849 ZINC
    143338 ChEBI
    CB5501380 ChemicalBook
    The data in this table is sourced from UniChem at EBI.