Dataset

Meprobamate; LC-ESI-Q; MS; POS; 45 V

This MassBank record with Accession MSBNK-Waters-WA001056 contains the MS mass spectrum of Meprobamate with the InChIkey NPPQSCRMBWNHMW-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C9H18N2O4/c1-3-4-9(2,5-14-7(10)12)6-15-8(11)13/h3-6H2,1-2H3,(H2,10,12)(H2,11,13)
SMILES CCCC(C)(COC(N)=O)COC(N)=O
InChI Key NPPQSCRMBWNHMW-UHFFFAOYSA-N
Molecular Formula C9H18N2O4
Exact Mass 218.127 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-WA001056
Version
Author
Maintainer
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MetadataPublished 2016-01-19
Related Molecule
  • [2-(carbamoyloxymethyl)-2-methylpentyl] carbamate
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    HMDB0014515 Human Metabolome Database
    meprobamate DailyMed
    SCHEMBL15286 SureChEMBL
    9I7LNY769Q FDA SRS
    4064 PubChem
    PD010221 ProbesDrugs
    14822610 PubChem: Thomson Pharma
    PA450377 PharmGKB
    57-53-4 ACToR
    591510 eMolecules
    MEPROBAMATE DailyMed
    MEPROBAMATE rxnorm
    DTXSID3023261 EPA CompTox Dashboard
    J4.475J Nikkaji
    1704 DrugCentral
    ZINC000001530701 ZINC
    7225 Guide to Pharmacology
    6761 ChEBI
    CHEMBL979 ChEMBL
    DB00371 DrugBank
    The data in this table is sourced from UniChem at EBI.