Dataset

Oxazepam; LC-ESI-Q; MS; POS; 15 V

This MassBank record with Accession MSBNK-Waters-WA000729 contains the MS mass spectrum of Oxazepam with the InChIkey ADIMAYPTOBDMTL-HNNXBMFYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C15H11ClN2O2/c16-10-6-7-12-11(8-10)13(9-4-2-1-3-5-9)18-15(20)14(19)17-12/h1-8,15,20H,(H,17,19)/t15-/m0/s1
SMILES Clc(c3)cc(c(c3)2)C(=NC(O)C(=O)N2)c(c1)cccc1
InChI Key ADIMAYPTOBDMTL-HNNXBMFYSA-N
Molecular Formula C15H11ClN2O2
Exact Mass 286.051 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-WA000729
Version
Author
Maintainer
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MetadataPublished 2016-01-19
Related Molecule
  • (3S)-7-chloro-3-hydroxy-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
    SCHEMBL528376 SureChEMBL
    14751155 PubChem: Thomson Pharma
    667436 PubChem
    212032 Brenda
    CHEMBL1743322 ChEMBL
    ZINC000000000575 ZINC
    OXAPAM CCDC
    J513.259B Nikkaji
    The data in this table is sourced from UniChem at EBI.