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Methyl ioxynil
SpectraBase Compound ID HvqDXUUYyXG
InChI InChI=1S/C8H5I2NO/c1-12-8-6(9)2-5(4-11)3-7(8)10/h2-3H,1H3
InChIKey LDZMXYUHLHAQAY-UHFFFAOYSA-N
Mol Weight 384.94 g/mol
Molecular Formula C8H5I2NO
Exact Mass 384.846054 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8TfEiJh93AY
Name Methyl ioxynil
Source of Sample Sigma-Aldrich Cat. #36198
CAS Registry Number 3336-40-1
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 384.846053784 u
Formula C8H5I2NO
InChI InChI=1S/C8H5I2NO/c1-12-8-6(9)2-5(4-11)3-7(8)10/h2-3H,1H3
InChIKey LDZMXYUHLHAQAY-UHFFFAOYSA-N
Molecular Weight 384.943 g/mol
Number of Peaks 48
RI1 1887
SMILES c1(c(OC)c(I)cc(C#N)c1)I
SPLASH splash10-000i-6239000000-bda6c8b6f9079709127e
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 Benzonitrile, 3,5-diiodo-4-methoxy-
Wiley ID LM_PEST_563