Dataset

Meclofenamic acid; LC-ESI-QTOF; MS2; 110 V

This MassBank record with Accession MSBNK-BAFG-CSL2311096349 contains the MS2 mass spectrum of Meclofenamic acid with the InChIkey SBDNJUWAMKYJOX-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C14H11Cl2NO2/c1-8-6-7-10(15)13(12(8)16)17-11-5-3-2-4-9(11)14(18)19/h2-7,17H,1H3,(H,18,19)
SMILES Cc1ccc(c(c1Cl)Nc2ccccc2C(=O)O)Cl
InChI Key SBDNJUWAMKYJOX-UHFFFAOYSA-N
Molecular Formula C14H11Cl2NO2
Exact Mass 295.017 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-BAFG-CSL2311096349
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MetadataPublished 2023-11-09
Related Molecule
  • 2-(2,6-dichloro-3-methylanilino)benzoic acid
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    DB00939 drugbank
    CHEBI:6710 chebi
    JMS rcsb_pdb
    CHEMBL509 chembl
    106 surechembl
    29373906 surechembl
    29379636 surechembl
    4037 pubchem
    48I5LU4ZWD fdasrs
    JMS pdbe
    7219 gtopdb
    PD009630 probes_and_drugs
    MECLOF CCDC
    14076 brenda
    183346 brenda
    5993 brenda
    HMDB0015074 hmdb
    DTXSID0048559 comptox
    NCT02930005 clinicaltrials
    Molport-006-112-212 molport
    1650 drugcentral
    22971 bindingdb
    The data in this table is sourced from UniChem at EBI.