Dataset

Coumoxystrobin; LC-ESI-QFT; MS2; CE: 150%; R=17500; [M+H]+

This MassBank record with Accession MSBNK-Eawag-EQ01121917 contains the MS2 mass spectrum of Coumoxystrobin with the InChIkey CWVRPJSBNHNJSI-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C26H28O6/c1-5-6-10-21-17(2)20-13-12-19(14-24(20)32-26(21)28)31-15-18-9-7-8-11-22(18)23(16-29-3)25(27)30-4/h7-9,11-14,16H,5-6,10,15H2,1-4H3
SMILES CCCCC1=C(C2=C(C=C(C=C2)OCC3=CC=CC=C3C(=COC)C(=O)OC)OC1=O)C
InChI Key CWVRPJSBNHNJSI-UHFFFAOYSA-N
Molecular Formula C26H28O6
Exact Mass 436.189 g/mol

Data and Resources

Metadata Information

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DOI
License URL https://creativecommons.org/licenses/by-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Eawag-EQ01121917
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MetadataPublished 2023-04-27
Related Molecule
  • methyl 2-[2-[(3-butyl-4-methyl-2-oxochromen-7-yl)oxymethyl]phenyl]-3-methoxyprop-2-enoate
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    27750674 surechembl
    75114051 pubchem
    Molport-052-042-578 molport
    The data in this table is sourced from UniChem at EBI.