Dataset

Atrazine; LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+

This MassBank record with Accession MSBNK-CASMI_2016-SM841401 contains the MS2 mass spectrum of Atrazine with the InChIkey MXWJVTOOROXGIU-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C8H14ClN5/c1-4-10-7-12-6(9)13-8(14-7)11-5(2)3/h5H,4H2,1-3H3,(H2,10,11,12,13,14)
SMILES CCNc1nc(Cl)nc(NC(C)C)n1
InChI Key MXWJVTOOROXGIU-UHFFFAOYSA-N
Molecular Formula C8H14ClN5
Exact Mass 215.094 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-CASMI_2016-SM841401
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MetadataPublished 2016-12-12
Related Molecule
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    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    No additional information available for this Dataset.