Dataset

Spirotetramat BYI08330-ketohydroxy; LC-ESI-QFT; MS2; CE: 75%; R=17500; [M+H]+

This MassBank record with Accession MSBNK-Eawag-EQ01131105 contains the MS2 mass spectrum of Spirotetramat BYI08330-ketohydroxy with the InChIkey XOVCVOLJZHNHLA-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C18H23NO4/c1-11-4-5-12(2)14(10-11)18(22)15(20)17(19-16(18)21)8-6-13(23-3)7-9-17/h4-5,10,13,22H,6-9H2,1-3H3,(H,19,21)
SMILES CC1=CC(=C(C=C1)C)C2(C(=O)C3(CCC(CC3)OC)NC2=O)O
InChI Key XOVCVOLJZHNHLA-UHFFFAOYSA-N
Molecular Formula C18H23NO4
Exact Mass 317.163 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-EQ01131105
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MetadataPublished 2023-04-27
Related Molecule
  • 3-(2,5-dimethylphenyl)-3-hydroxy-8-methoxy-1-azaspiro[4.5]decane-2,4-dione
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    71312325 PubChem
    DTXSID70746766 EPA CompTox Dashboard
    The data in this table is sourced from UniChem at EBI.