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Isomethiozin
SpectraBase Compound ID DUkiNQjvWG2
InChI InChI=1S/C12H20N4OS/c1-8(2)7-13-16-10(17)9(12(3,4)5)14-15-11(16)18-6/h7-8H,1-6H3/b13-7+
InChIKey MZTLOILRKLUURT-NTUHNPAUSA-N
Mol Weight 268.38 g/mol
Molecular Formula C12H20N4OS
Exact Mass 268.135782 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B3oVpyy656e
Name Isomethiozin
CAS Registry Number 57052-04-7
Classification Herbicide
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 268.135782453 u
Formula C12H20N4OS
InChI InChI=1S/C12H20N4OS/c1-8(2)7-13-16-10(17)9(12(3,4)5)14-15-11(16)18-6/h7-8H,1-6H3/b13-7+
InChIKey MZTLOILRKLUURT-NTUHNPAUSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 268.379 g/mol
Nominal Mass 268 u
Quality 916
Retention Index 2006
SMILES C1(N(C(=NN=C1C(C)(C)C)SC)\N=C\C(C)C)=O
SPLASH splash10-004m-9650000000-a48f1e72f23960cd1358
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 6-tert-Butyl-4-iso-butylideneamino-3-methylthio-1,2,4-triazin-5(4H)-one
Technique GC/MS
Wiley ID DD2024_011820