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Dinoseb acetate
SpectraBase Compound ID FCDrAkjt3eG
InChI InChI=1S/C12H14N2O6/c1-4-7(2)10-5-9(13(16)17)6-11(14(18)19)12(10)20-8(3)15/h5-7H,4H2,1-3H3
InChIKey RDJTWDKSYLLHRW-UHFFFAOYSA-N
Mol Weight 282.25 g/mol
Molecular Formula C12H14N2O6
Exact Mass 282.085186 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IqcdDZBF9sN
Name Dinoseb acetate
Source of Sample Sigma-Aldrich Cat. #31281
CAS Registry Number 2813-95-8
Classification Pesticides: Herbicides
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 282.085186173 u
Formula C12H14N2O6
InChI InChI=1S/C12H14N2O6/c1-4-7(2)10-5-9(13(16)17)6-11(14(18)19)12(10)20-8(3)15/h5-7H,4H2,1-3H3
InChIKey RDJTWDKSYLLHRW-UHFFFAOYSA-N
Molecular Weight 282.252 g/mol
Number of Peaks 48
RI1 1911
SMILES c1(cc(c(c(c1)C(C)CC)OC(C)=O)N(=O)=O)N(=O)=O
SPLASH splash10-0006-9000000000-c31c5dd1e7fbd830ea93
Sample Comments RI1: measured on SLB-5ms (Alkanes) RI2: measured on Equity-1 (Alkanes)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms Phenol, 2-(1-methylpropyl)-4,6-dinitro-, 1-acetate
Wiley ID LM_PEST_748