Dataset

Nordazepam; LC-ESI-Q; MS; POS; 90 V

This MassBank record with Accession MSBNK-Waters-WA000742 contains the MS mass spectrum of Nordazepam with the InChIkey AKPLHCDWDRPJGD-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C15H11ClN2O/c16-11-6-7-13-12(8-11)15(17-9-14(19)18-13)10-4-2-1-3-5-10/h1-8H,9H2,(H,18,19)
SMILES O=C(C2)Nc(c3)c(cc(Cl)c3)C(=N2)c(c1)cccc1
InChI Key AKPLHCDWDRPJGD-UHFFFAOYSA-N
Molecular Formula C15H11ClN2O
Exact Mass 270.056 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-WA000742
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MetadataPublished 2016-01-19
Related Molecule
  • 7-chloro-5-phenyl-1,3-dihydro-1,4-benzodiazepin-2-one
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    DOZKEI CCDC
    J7.250H Nikkaji
    816 DrugCentral
    NORDAZEPAM rxnorm
    50027835 BindingDB
    DTXSID2049000 EPA CompTox Dashboard
    CB2292432 ChemicalBook
    ZINC000001249069 ZINC
    C07486 KEGG Ligand
    111762 ChEBI
    CHEMBL523 ChEMBL
    2997 PubChem
    60021023 NMRShiftDB
    PD014374 ProbesDrugs
    14819793 PubChem: Thomson Pharma
    C07486 Recon
    1088-11-5 ACToR
    67220MCM01 FDA SRS
    524668 eMolecules
    30326489 eMolecules
    DB14028 DrugBank
    MTBLC111762 Metabolights
    HMDB0060538 Human Metabolome Database
    MCULE-2705262252 Mcule
    SCHEMBL78453 SureChEMBL
    The data in this table is sourced from UniChem at EBI.