Dataset

Sulfadiazine; LC-ESI-ITFT; MS2; CE: 15%; R=7500; [M+H]+

This MassBank record with Accession MSBNK-Eawag-EA017902 contains the MS2 mass spectrum of Sulfadiazine with the InChIkey SEEPANYCNGTZFQ-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C10H10N4O2S/c11-8-2-4-9(5-3-8)17(15,16)14-10-12-6-1-7-13-10/h1-7H,11H2,(H,12,13,14)
SMILES NC1=CC=C(C=C1)S(=O)(=O)NC2=NC=CC=N2
InChI Key SEEPANYCNGTZFQ-UHFFFAOYSA-N
Molecular Formula C10H10N4O2S
Exact Mass 250.052 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-Eawag-EA017902
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MetadataPublished 2014-01-14
Related Molecule
  • 4-amino-N-pyrimidin-2-ylbenzenesulfonamide
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    DB00359 drugbank
    CHEBI:9328 chebi
    CHEMBL439 chembl
    24176 surechembl
    5215 pubchem
    0N7609K889 fdasrs
    12635 gtopdb
    PD001750 probes_and_drugs
    SULDAZ CCDC
    226953 brenda
    3097 brenda
    HMDB0014503 hmdb
    Molport-000-629-738 molport
    2500 drugcentral
    50166571 bindingdb
    The data in this table is sourced from UniChem at EBI.