Dataset

Fusaperazine E; LC-ESI-ITFT; MS2; CE: 20; R=17500; [M+H]+

This MassBank record with Accession MSBNK-AAFC-AC000748 contains the MS2 mass spectrum of Fusaperazine E with the InChIkey QXYMNBLAEDQYLV-VBKFSLOCSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C19H24N2O3S/c1-13(2)10-11-24-15-8-6-14(7-9-15)12-16-17(22)21(4)19(25-5)18(23)20(16)3/h6-10,12,19H,11H2,1-5H3/b16-12-
SMILES CC(=CCOC1=CC=C(C=C1)/C=C\2/C(=O)N(C(C(=O)N2C)SC)C)C
InChI Key QXYMNBLAEDQYLV-VBKFSLOCSA-N
Molecular Formula C19H24N2O3S
Exact Mass 360.151 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-AAFC-AC000748
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MetadataPublished 2017-07-07
Related Molecule
  • (3Z)-1,4-dimethyl-3-[[4-(3-methylbut-2-enoxy)phenyl]methylidene]-6-methylsulfanylpiperazine-2,5-dione
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    J2.859.458E Nikkaji
    101520130 PubChem
    DTXSID60894028 EPA CompTox Dashboard
    The data in this table is sourced from UniChem at EBI.