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2,3,7-tribromo-8-chloro-dibenzo-p-dioxin
SpectraBase Compound ID LPS8mhUaRe6
InChI InChI=1S/C12H4Br3ClO2/c13-5-1-9-10(2-6(5)14)18-12-4-8(16)7(15)3-11(12)17-9/h1-4H
InChIKey VAPXVPBAPGEGAW-UHFFFAOYSA-N
Mol Weight 455.33 g/mol
Molecular Formula C12H4Br3ClO2
Exact Mass 451.744996 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JvzdtvZgD6l
Name 2,3,7-tribromo-8-chloro-dibenzo-p-dioxin
Comments Less than 3 mono-isotopic peaks
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Formula C12H4Br3ClO2
InChI InChI=1S/C12H4Br3ClO2/c13-5-1-9-10(2-6(5)14)18-12-4-8(16)7(15)3-11(12)17-9/h1-4H
InChIKey VAPXVPBAPGEGAW-UHFFFAOYSA-N
Molecular Weight 455.327 g/mol
SMILES c12Oc3c(Oc2cc(c(c1)Cl)Br)cc(c(c3)Br)Br
SPLASH splash10-0pb9-0000900000-630b808a5e1a05003180
Source of Spectrum F1-332-227-0
Synonyms 2,3,7-tris(bromanyl)-8-chloranyl-dibenzo-p-dioxin
Wiley ID 1559760