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3,5-Dichloro-4-hydroxybenzonitrile
SpectraBase Compound ID 5kWj2jduzaC
InChI InChI=1S/C7H3Cl2NO/c8-5-1-4(3-10)2-6(9)7(5)11/h1-2,11H
InChIKey YRSSHOVRSMQULE-UHFFFAOYSA-N
Mol Weight 188.01 g/mol
Molecular Formula C7H3Cl2NO
Exact Mass 186.959169 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 446PFuTb49G
Name Chloroxynil
Source of Sample Sigma-Aldrich Cat. #33363
CAS Registry Number 1891-95-8
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 186.959169120 u
Formula C7H3Cl2NO
InChI InChI=1S/C7H3Cl2NO/c8-5-1-4(3-10)2-6(9)7(5)11/h1-2,11H
InChIKey YRSSHOVRSMQULE-UHFFFAOYSA-N
Molecular Weight 188.013 g/mol
Number of Peaks 47
RI1 1490
SMILES Oc1c(cc(cc1Cl)C#N)Cl
SPLASH splash10-000i-4900000000-e55c685b7ecba9cb8c22
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-dichloro-4-hydroxy-
Wiley ID LM_PEST_561