Dataset

Sulfamethizole; LC-ESI-QTOF; MS2; CE: Ramp 20.6-30.8 eV; R=35000; [M+H]+

This MassBank record with Accession MSBNK-Athens_Univ-AU101702 contains the MS2 mass spectrum of Sulfamethizole with the InChIkey VACCAVUAMIDAGB-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C9H10N4O2S2/c1-6-11-12-9(16-6)13-17(14,15)8-4-2-7(10)3-5-8/h2-5H,10H2,1H3,(H,12,13)
SMILES Cc1nnc(s1)NS(=O)(=O)c2ccc(cc2)N
InChI Key VACCAVUAMIDAGB-UHFFFAOYSA-N
Molecular Formula C9H10N4O2S2
Exact Mass 270.024 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Athens_Univ-AU101702
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MetadataPublished 2015-07-05
Related Molecule
  • 4-amino-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzenesulfonamide
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    DB00576 drugbank
    CHEBI:9331 chebi
    CHEMBL1191 chembl
    26453 surechembl
    5328 pubchem
    25W8454H16 fdasrs
    12683 gtopdb
    PD001747 probes_and_drugs
    AMUTOT CCDC
    38417 brenda
    HMDB0014715 hmdb
    Molport-000-876-475 molport
    2512 drugcentral
    50295558 bindingdb
    The data in this table is sourced from UniChem at EBI.