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Hexabromobenzene
SpectraBase Compound ID EMjyHS4xp43
InChI InChI=1S/C6Br6/c7-1-2(8)4(10)6(12)5(11)3(1)9
InChIKey CAYGQBVSOZLICD-UHFFFAOYSA-N
Mol Weight 551.49 g/mol
Molecular Formula C6Br6
Exact Mass 545.510028 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3natwaAIoBU
Name Hexabromobenzene
Source of Sample Sigma-Aldrich Cat. #45524
CAS Registry Number 87-82-1
Classification Pesticides
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 545.510028000 u
Formula C6Br6
InChI InChI=1S/C6Br6/c7-1-2(8)4(10)6(12)5(11)3(1)9
InChIKey CAYGQBVSOZLICD-UHFFFAOYSA-N
Molecular Weight 551.490 g/mol
Number of Peaks 49
RI1 2450
SMILES c1(c(c(Br)c(c(c1Br)Br)Br)Br)Br
SPLASH splash10-006t-2865890000-82fabe6a9263941f15c1
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 Benzene, 1,2,3,4,5,6-hexabromo-
Wiley ID LM_PEST_818