Dataset

Chloroxuron; LC-ESI-ITFT; MS2; CE: 35; R=15000; [M+H]+

This MassBank record with Accession MSBNK-UFZ-UF404603 contains the MS2 mass spectrum of Chloroxuron with the InChIkey IVUXTESCPZUGJC-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C15H15ClN2O2/c1-18(2)15(19)17-12-5-9-14(10-6-12)20-13-7-3-11(16)4-8-13/h3-10H,1-2H3,(H,17,19)
SMILES CN(C)C(=O)NC1=CC=C(OC2=CC=C(Cl)C=C2)C=C1
InChI Key IVUXTESCPZUGJC-UHFFFAOYSA-N
Molecular Formula C15H15ClN2O2
Exact Mass 290.082 g/mol

Data and Resources

Metadata Information

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DOI
License URL https://creativecommons.org/licenses/by/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-UFZ-UF404603
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MetadataPublished 2017-01-05
Related Molecule
  • 3-[4-(4-chlorophenoxy)phenyl]-1,1-dimethylurea
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEBI:82200 chebi
    CHEMBL1568699 chembl
    132843 surechembl
    16115 pubchem
    QER23C88ME fdasrs
    HMDB0250129 hmdb
    Molport-003-933-348 molport
    The data in this table is sourced from UniChem at EBI.