Dataset

Zonisamide; LC-ESI-QQ; MS2; ESI; NEGATIVE; CID; CE 40 V; [M-H]-

This MassBank record with Accession MSBNK-MSSJ-MSJ03115 contains the MS2 mass spectrum of Zonisamide with the InChIkey UBQNRHZMVUUOMG-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C8H8N2O3S/c9-14(11,12)5-7-6-3-1-2-4-8(6)13-10-7/h1-4H,5H2,(H2,9,11,12)
SMILES C1=CC=C2C(=C1)C(=NO2)CS(=O)(=O)N
InChI Key UBQNRHZMVUUOMG-UHFFFAOYSA-N
Molecular Formula C8H8N2O3S
Exact Mass 212.026 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-MSSJ-MSJ03115
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MetadataPublished 2023-04-05
Related Molecule
  • 1,2-benzoxazol-3-ylmethanesulfonamide
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    50028010 BindingDB
    10888 BindingDB
    VUXPUZ CCDC
    J20.559A Nikkaji
    7047 Guide to Pharmacology
    ZINC000000004321 ZINC
    2872 DrugCentral
    DTXSID9046023 EPA CompTox Dashboard
    HY-B0124 MedChemExpress
    CI-912 clinicaltrials
    ZONISAMIDE clinicaltrials
    ZONEGRAN clinicaltrials
    AD-810 clinicaltrials
    ZONEGRAN rxnorm
    ZONISAMIDE rxnorm
    ZONISAMIDE DailyMed
    SAM002548957 NIH Clinical Collection
    10127 ChEBI
    ZON PDBe
    12012838 PubChem: Drugs of the Future
    C07504 KEGG Ligand
    DB00909 DrugBank
    CHEMBL750 ChEMBL
    165533 Brenda
    1295 Brenda
    CB0252441 ChemicalBook
    zonisamide DailyMed
    HMDB0015045 Human Metabolome Database
    MCULE-1873297847 Mcule
    15220241 PubChem: Thomson Pharma
    LSM-3062 LINCS
    5734 PubChem
    11967800 PubChem
    SCHEMBL35458 SureChEMBL
    459384H98V FDA SRS
    PD002942 ProbesDrugs
    PA451978 PharmGKB
    68291-97-4 ACToR
    Zonisamide Selleck
    902702 eMolecules
    The data in this table is sourced from UniChem at EBI.