Dataset

Norfludiazepam; LC-ESI-QTOF; MS2; CE: 40 eV; R=35000; [M+H]+

This MassBank record with Accession MSBNK-Athens_Univ-AU228604 contains the MS2 mass spectrum of Norfludiazepam with the InChIkey UVCOILFBWYKHHB-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C15H10ClFN2O/c16-9-5-6-13-11(7-9)15(18-8-14(20)19-13)10-3-1-2-4-12(10)17/h1-7H,8H2,(H,19,20)
SMILES c1ccc(c(c1)C2=NCC(=O)Nc3c2cc(cc3)Cl)F
InChI Key UVCOILFBWYKHHB-UHFFFAOYSA-N
Molecular Formula C15H10ClFN2O
Exact Mass 288.047 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-AU228604
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MetadataPublished 2018-12-19
Related Molecule
  • 7-chloro-5-(2-fluorophenyl)-1,3-dihydro-1,4-benzodiazepin-2-one
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CB4316060 ChemicalBook
    HMDB0061161 Human Metabolome Database
    SCHEMBL5177297 SureChEMBL
    592563 eMolecules
    4540 PubChem
    PD013945 ProbesDrugs
    15345031 PubChem: Thomson Pharma
    2886-65-9 ACToR
    X9U41NXR6M FDA SRS
    ZINC000001433338 ZINC
    809 DrugCentral
    135197 ChEBI
    DTXSID30183057 EPA CompTox Dashboard
    J13.722G Nikkaji
    50408014 BindingDB
    DOZKUY CCDC
    CHEMBL974 ChEMBL
    The data in this table is sourced from UniChem at EBI.