Dataset

Cycloxydim-TP BH 517-TSO E/Z-isomer; LC-ESI-QFT; MS2; CE: 90%; R=17500; [M+H]+

This MassBank record with Accession MSBNK-Eawag-EQ418206 contains the MS2 mass spectrum of Cycloxydim-TP BH 517-TSO E/Z-isomer with the InChIkey SVKHAVSUBSUFBQ-NBVRZTHBSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C17H27NO4S/c1-3-6-14(18-22-4-2)17-15(19)9-13(10-16(17)20)12-7-5-8-23(21)11-12/h12-13,19H,3-11H2,1-2H3/b18-14+
SMILES CCC\C(=N/OCC)C1=C(O)CC(CC1=O)C1CCCS(=O)C1
InChI Key SVKHAVSUBSUFBQ-NBVRZTHBSA-N
Molecular Formula C17H27NO4S
Exact Mass 341.166 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-EQ418206
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MetadataPublished 2019-12-03
Related Molecule
  • 2-[(E)-N-ethoxy-C-propylcarbonimidoyl]-3-hydroxy-5-(1-oxothian-3-yl)cyclohex-2-en-1-one
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    145740499 pubchem
    The data in this table is sourced from UniChem at EBI.