Dataset

Mefenamic acid; LC-ESI-ITFT; MS2; CE: 80; R=15000; [M-H]-

This MassBank record with Accession MSBNK-UFZ-UF409452 contains the MS2 mass spectrum of Mefenamic acid with the InChIkey HYYBABOKPJLUIN-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C15H15NO2/c1-10-6-5-9-13(11(10)2)16-14-8-4-3-7-12(14)15(17)18/h3-9,16H,1-2H3,(H,17,18)
SMILES CC1=C(C)C(NC2=CC=CC=C2C(O)=O)=CC=C1
InChI Key HYYBABOKPJLUIN-UHFFFAOYSA-N
Molecular Formula C15H15NO2
Exact Mass 241.110 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-UFZ-UF409452
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MetadataPublished 2017-01-05
Related Molecule
  • 2-(2,3-dimethylanilino)benzoic acid
  • 2-(2,3-dimethylanilino)benzoic acid
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    DB00784 drugbank
    CHEBI:6717 chebi
    ID8 rcsb_pdb
    CHEMBL686 chembl
    29350572 surechembl
    29355128 surechembl
    29465887 surechembl
    3544 surechembl
    4044 pubchem
    367589PJ2C fdasrs
    2593 gtopdb
    PD001903 probes_and_drugs
    MUPNEQ CCDC
    2086 brenda
    HMDB0014922 hmdb
    127164 bindingdb
    176655 bindingdb
    176680 bindingdb
    178953 bindingdb
    179013 bindingdb
    179014 bindingdb
    50316357 bindingdb
    50316363 bindingdb
    50376559 bindingdb
    50739702 bindingdb
    50746930 bindingdb
    50746957 bindingdb
    50772658 bindingdb
    50773244 bindingdb
    50773432 bindingdb
    50773590 bindingdb
    50815079 bindingdb
    50815087 bindingdb
    50967557 bindingdb
    50967568 bindingdb
    50967598 bindingdb
    51055995 bindingdb
    51055998 bindingdb
    51056001 bindingdb
    51056004 bindingdb
    51056007 bindingdb
    51056010 bindingdb
    51235751 bindingdb
    51252291 bindingdb
    51252301 bindingdb
    51252314 bindingdb
    51341573 bindingdb
    51414199 bindingdb
    51414212 bindingdb
    Molport-001-839-968 molport
    1663 drugcentral
    The data in this table is sourced from UniChem at EBI.