Dataset

Midazolam; LC-ESI-QTOF; MS2; HILIC; CE: 50 eV; R=35000; [M+H]+

This MassBank record with Accession MSBNK-Athens_Univ-AU155911 contains the MS2 mass spectrum of Midazolam with the InChIkey DDLIGBOFAVUZHB-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C18H13ClFN3/c1-11-21-9-13-10-22-18(14-4-2-3-5-16(14)20)15-8-12(19)6-7-17(15)23(11)13/h2-9H,10H2,1H3
SMILES CC1=NC=C2N1C3=C(C=C(C=C3)Cl)C(=NC2)C4=CC=CC=C4F
InChI Key DDLIGBOFAVUZHB-UHFFFAOYSA-N
Molecular Formula C18H13ClFN3
Exact Mass 325.078 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-Athens_Univ-AU155911
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MetadataPublished 2016-02-26
Related Molecule
  • 8-chloro-6-(2-fluorophenyl)-1-methyl-4H-imidazo[1,5-a][1,4]benzodiazepine
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    DB00683 drugbank
    CHEBI:6931 chebi
    08J rcsb_pdb
    CHEMBL655 chembl
    29357425 surechembl
    29480459 surechembl
    29565146 surechembl
    35061 surechembl
    4192 pubchem
    R60L0SM5BC fdasrs
    3342 gtopdb
    PD009850 probes_and_drugs
    CUYCAB CCDC
    12205 brenda
    145058 brenda
    145972 brenda
    HMDB0014821 hmdb
    1802 drugcentral
    21363 bindingdb
    The data in this table is sourced from UniChem at EBI.