Dataset

ETHYL N-(PARA-CHLOROPHENYL)CARBAMATE; EI-B; MS

This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP004147 contains the MS mass spectrum of ETHYL N-(PARA-CHLOROPHENYL)CARBAMATE with the InChIkey WSKXXIMERYQVGJ-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C9H10ClNO2/c1-2-13-9(12)11-8-5-3-7(10)4-6-8/h3-6H,2H2,1H3,(H,11,12)
SMILES CCOC(=O)Nc(c1)ccc(Cl)c1
InChI Key WSKXXIMERYQVGJ-UHFFFAOYSA-N
Molecular Formula C9H10ClNO2
Exact Mass 199.040 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-nc-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Fac_Eng_Univ_Tokyo-JP004147
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MetadataPublished 2016-01-19
Related Molecule
  • ethyl N-(4-chlorophenyl)carbamate
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    17496 PubChem
    MCULE-2431684915 Mcule
    15911743 PubChem: Thomson Pharma
    2621-80-9 ACToR
    SCHEMBL1187952 SureChEMBL
    2893690 eMolecules
    DTXSID00180851 EPA CompTox Dashboard
    J42.823J Nikkaji
    ZINC000000393890 ZINC
    The data in this table is sourced from UniChem at EBI.