Dataset

Benserazide; LC-ESI-QFT; MS2; CE: 15; R=35000; [M-H]-

This MassBank record with Accession MSBNK-Eawag-EQ285351 contains the MS2 mass spectrum of Benserazide with the InChIkey BNQDCRGUHNALGH-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C10H15N3O5/c11-6(4-14)10(18)13-12-3-5-1-2-7(15)9(17)8(5)16/h1-2,6,12,14-17H,3-4,11H2,(H,13,18)
SMILES O=C(NNCc1c(O)c(O)c(O)cc1)C(N)CO
InChI Key BNQDCRGUHNALGH-UHFFFAOYSA-N
Molecular Formula C10H15N3O5
Exact Mass 257.101 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-EQ285351
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MetadataPublished 2015-08-25
Related Molecule
  • 2-amino-3-hydroxy-N'-[(2,3,4-trihydroxyphenyl)methyl]propanehydrazide
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    DB12783 drugbank
    CHEBI:64187 chebi
    CHEMBL1096979 chembl
    29401071 surechembl
    34522 surechembl
    2327 pubchem
    762OS3ZEJU fdasrs
    5150 gtopdb
    PD013354 probes_and_drugs
    10586 brenda
    147310 brenda
    96905 brenda
    96907 brenda
    HMDB0248960 hmdb
    DTXSID9022651 comptox
    NCT00144209 clinicaltrials
    NCT01227655 clinicaltrials
    NCT01327261 clinicaltrials
    NCT01533116 clinicaltrials
    NCT01568073 clinicaltrials
    NCT02169414 clinicaltrials
    NCT02741947 clinicaltrials
    NCT02741947 clinicaltrials
    NCT02778594 clinicaltrials
    NCT03333369 clinicaltrials
    NCT04432623 clinicaltrials
    314 drugcentral
    49122 bindingdb
    The data in this table is sourced from UniChem at EBI.