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2,3,4,6-Tetrachlorophenol
SpectraBase Compound ID IPmKIOgg4hl
InChI InChI=1S/C6H2Cl4O/c7-2-1-3(8)6(11)5(10)4(2)9/h1,11H
InChIKey VGVRPFIJEJYOFN-UHFFFAOYSA-N
Mol Weight 231.9 g/mol
Molecular Formula C6H2Cl4O
Exact Mass 229.885975 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2DVXml1SXs6
Name 2,3,4,6-Tetrachlorophenol
Source of Sample LGC Cat. #DRE-XA17374600ME; www.lgcstandards.com
CAS Registry Number 58-90-2
Classification Pesticides: Fungicides
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 229.885975483 u
Formula C6H2Cl4O
InChI InChI=1S/C6H2Cl4O/c7-2-1-3(8)6(11)5(10)4(2)9/h1,11H
InChIKey VGVRPFIJEJYOFN-UHFFFAOYSA-N
Molecular Weight 231.893 g/mol
Number of Peaks 50
RI1 1549
RI2 1519
SMILES Oc1c(c(Cl)c(cc1Cl)Cl)Cl
SPLASH splash10-001i-7960000000-53cff87bf93a270a80b7
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, 2,3,4,6-tetrachloro-
Wiley ID LM_PEST_961