Dataset

Midazolam; LC-ESI-Q; MS; POS; 15 V, 30 V

This MassBank record with Accession MSBNK-Waters-WA001079 contains the MS 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 Clc(c3)cc(C=1c(c4)c(F)ccc4)c(c3)n(c(C)2)c(cn2)CN1
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-nc/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Waters-WA001079
Version
Author
Maintainer
Language
MetadataPublished 2016-01-19
Related Molecule
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    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CB0418580 ChemicalBook
    midazolam DailyMed
    HMDB0014821 Human Metabolome Database
    145972 Brenda
    145058 Brenda
    12205 Brenda
    ZINC000095626706 ZINC
    4192 PubChem
    PD009850 ProbesDrugs
    SEIZALAM clinicaltrials
    08J PDBe
    R60L0SM5BC FDA SRS
    14850779 PubChem: Thomson Pharma
    59467-70-8 ACToR
    SCHEMBL35061 SureChEMBL
    PA450496 PharmGKB
    LSM-5200 LINCS
    595333 eMolecules
    MIDAZOLAM MALEATE rxnorm
    BUCCOLAM clinicaltrials
    MIDAZOLAM HYDROCHLORIDE clinicaltrials
    MIDAZOLAM MALEATE clinicaltrials
    MIDAZOLAM clinicaltrials
    VERSED clinicaltrials
    DORMICUM clinicaltrials
    USL-261 clinicaltrials
    USL261 clinicaltrials
    SHP-615 clinicaltrials
    SHP615 clinicaltrials
    6931 ChEBI
    DTXSID5023320 EPA CompTox Dashboard
    1802 DrugCentral
    3342 Guide to Pharmacology
    J31.859K Nikkaji
    MIDAZOLAM rxnorm
    SEIZALAM rxnorm
    MIDAZOLAM HYDROCHLORIDE rxnorm
    MIDAZOLAM DailyMed
    NAYZILAM rxnorm
    21363 BindingDB
    CUYCAB CCDC
    C07524 KEGG Ligand
    DB00683 DrugBank
    CHEMBL655 ChEMBL
    The data in this table is sourced from UniChem at EBI.