Dataset

Acetochlor OXA; LC-ESI-ITFT; MS2; CE: 45%; R=15000; [M-H]-

This MassBank record with Accession MSBNK-Eawag-EA010260 contains the MS2 mass spectrum of Acetochlor OXA with the InChIkey OTKTUNJJKYTOFF-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C14H19NO4/c1-4-11-8-6-7-10(3)12(11)15(9-19-5-2)13(16)14(17)18/h6-8H,4-5,9H2,1-3H3,(H,17,18)
SMILES c(cc(C)c1N(C(=O)C(=O)O)COCC)cc1CC
InChI Key OTKTUNJJKYTOFF-UHFFFAOYSA-N
Molecular Formula C14H19NO4
Exact Mass 265.131 g/mol

Data and Resources

Metadata Information

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DOI
License URL https://creativecommons.org/licenses/by/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Eawag-EA010260
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MetadataPublished 2014-01-14
Related Molecule
  • 2-[N-(ethoxymethyl)-2-ethyl-6-methylanilino]-2-oxoacetic acid
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    No additional information available for this Dataset.