Dataset

Fenoxaprop-P-ethyl; LC-ESI-QFT; MS2; CE: 45%; R=15000; [M+H]+

This MassBank record with Accession MSBNK-Eawag-EQ01089303 contains the MS2 mass spectrum of Fenoxaprop-P-ethyl with the InChIkey PQKBPHSEKWERTG-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C18H16ClNO5/c1-3-22-17(21)11(2)23-13-5-7-14(8-6-13)24-18-20-15-9-4-12(19)10-16(15)25-18/h4-11H,3H2,1-2H3
SMILES CCOC(=O)C(C)OC1=CC=C(C=C1)OC2=NC3=C(O2)C=C(C=C3)Cl
InChI Key PQKBPHSEKWERTG-UHFFFAOYSA-N
Molecular Formula C18H16ClNO5
Exact Mass 361.072 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Eawag-EQ01089303
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MetadataPublished 2024-06-14
Related Molecule
  • ethyl 2-[4-[(6-chloro-1,3-benzoxazol-2-yl)oxy]phenoxy]propanoate
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    DB05252 drugbank
    CHEBI:5008 chebi
    CHEMBL37932 chembl
    29499760 surechembl
    54528 surechembl
    47938 pubchem
    PD008634 probes_and_drugs
    129354 brenda
    129356 brenda
    231807 brenda
    62794 brenda
    7U20WEM458 fdasrs
    HMDB0252211 hmdb
    Molport-005-940-863 molport
    The data in this table is sourced from UniChem at EBI.