Dataset

Zopiclone; LC-ESI-Q; MS; POS; 75 V

This MassBank record with Accession MSBNK-Waters-WA000330 contains the MS mass spectrum of Zopiclone with the InChIkey GBBSUAFBMRNDJC-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C17H17ClN6O3/c1-22-6-8-23(9-7-22)17(26)27-16-14-13(19-4-5-20-14)15(25)24(16)12-3-2-11(18)10-21-12/h2-5,10,16H,6-9H2,1H3
SMILES CN(C4)CCN(C4)C(=O)OC(c21)N(c(c3)ncc(Cl)c3)C(=O)c(nccn2)1
InChI Key GBBSUAFBMRNDJC-UHFFFAOYSA-N
Molecular Formula C17H17ClN6O3
Exact Mass 388.105 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-WA000330
Version
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Maintainer
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MetadataPublished 2016-01-19
Related Molecule
  • [6-(5-chloropyridin-2-yl)-5-oxo-7H-pyrrolo[3,4-b]pyrazin-7-yl] 4-methylpiperazine-1-carboxylate
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    DB01198 DrugBank
    CHEMBL135400 ChEMBL
    32315 ChEBI
    12013157 PubChem: Drugs of the Future
    7430 Guide to Pharmacology
    CUHNEY CCDC
    ZOPICLONE rxnorm
    50248251 BindingDB
    ZOPICLONE clinicaltrials
    ZIMOVANE clinicaltrials
    DTXSID4041155 EPA CompTox Dashboard
    J16.885H Nikkaji
    03A5ORL08Q FDA SRS
    2873 DrugCentral
    5735 PubChem
    LSM-4408 LINCS
    43200-80-2 ACToR
    138680-07-6 ACToR
    PD009745 ProbesDrugs
    PA10236 PharmGKB
    14780617 PubChem: Thomson Pharma
    596296 eMolecules
    HMDB0015329 Human Metabolome Database
    CB1401303 ChemicalBook
    SCHEMBL44419 SureChEMBL
    MCULE-4633960136 Mcule
    The data in this table is sourced from UniChem at EBI.