Dataset

Trifloxystrobin; LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M+H]+

This MassBank record with Accession MSBNK-Athens_Univ-AU371401 contains the MS2 mass spectrum of Trifloxystrobin with the InChIkey ONCZDRURRATYFI-QTCHDTBASA-N.

Chemical Information

molecular Image
InChI InChI=1S/C20H19F3N2O4/c1-13(14-8-6-9-16(11-14)20(21,22)23)24-29-12-15-7-4-5-10-17(15)18(25-28-3)19(26)27-2/h4-11H,12H2,1-3H3/b24-13+,25-18-
SMILES CO\N=C(/C(=O)OC)C1=C(CO\N=C(/C)C2=CC(=CC=C2)C(F)(F)F)C=CC=C1
InChI Key ONCZDRURRATYFI-QTCHDTBASA-N
Molecular Formula C20H19F3N2O4
Exact Mass 408.130 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-Athens_Univ-AU371401
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MetadataPublished 2015-12-09
Related Molecule
  • methyl (2Z)-2-methoxyimino-2-[2-[[(E)-1-[3-(trifluoromethyl)phenyl]ethylideneamino]oxymethyl]phenyl]acetate
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEMBL3637899 chembl
    2321633 surechembl
    29363702 surechembl
    9578570 pubchem
    F625Z36B2D fdasrs
    PD061230 probes_and_drugs
    FOHROK CCDC
    Molport-052-014-969 molport
    The data in this table is sourced from UniChem at EBI.