Dataset

Amitraz; LC-ESI-ITFT; MS2; CE: 30%; R=7500; [M+H]+

This MassBank record with Accession MSBNK-Eawag-EA010703 contains the MS2 mass spectrum of Amitraz with the InChIkey QXAITBQSYVNQDR-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C19H23N3/c1-14-6-8-18(16(3)10-14)20-12-22(5)13-21-19-9-7-15(2)11-17(19)4/h6-13H,1-5H3
SMILES c1(c(cc(C)cc1)C)\N=C\N(\C=N\c1c(cc(C)cc1)C)C
InChI Key QXAITBQSYVNQDR-UHFFFAOYSA-N
Molecular Formula C19H23N3
Exact Mass 293.189 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Eawag-EA010703
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MetadataPublished 2014-01-14
Related Molecule
  • N'-(2,4-dimethylphenyl)-N-[(2,4-dimethylphenyl)iminomethyl]-N-methylmethanimidamide
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    MCULE-1585410947 Mcule
    ZINC000253495784 ZINC
    36324 PubChem
    PD055757 ProbesDrugs
    2665 ChEBI
    HMDB0248337 Human Metabolome Database
    The data in this table is sourced from UniChem at EBI.