Dataset

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

This MassBank record with Accession MSBNK-Eawag-EQ01125708 contains the MS2 mass spectrum of Fluacrypyrim with the InChIkey MXWAGQASUDSFBG-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C20H21F3N2O5/c1-12(2)30-19-24-16(20(21,22)23)9-17(25-19)29-10-13-7-5-6-8-14(13)15(11-27-3)18(26)28-4/h5-9,11-12H,10H2,1-4H3
SMILES CC(C)OC1=NC(=CC(=N1)OCC2=CC=CC=C2C(=COC)C(=O)OC)C(F)(F)F
InChI Key MXWAGQASUDSFBG-UHFFFAOYSA-N
Molecular Formula C20H21F3N2O5
Exact Mass 426.140 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-EQ01125708
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MetadataPublished 2023-04-27
Related Molecule
  • methyl 3-methoxy-2-[2-[[2-propan-2-yloxy-6-(trifluoromethyl)pyrimidin-4-yl]oxymethyl]phenyl]prop-2-enoate
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    5997532 surechembl
    53395020 pubchem
    The data in this table is sourced from UniChem at EBI.