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(2,3,6,8-tetrabromodibenzo-p-dioxin-1-yl) acetate
SpectraBase Compound ID D121fRd9a9M
InChI InChI=1S/C14H6Br4O4/c1-5(19)20-14-11(18)7(16)4-10-13(14)22-9-3-6(15)2-8(17)12(9)21-10/h2-4H,1H3
InChIKey GGYJAXCVZVWWLY-UHFFFAOYSA-N
Mol Weight 557.81 g/mol
Molecular Formula C14H6Br4O4
Exact Mass 553.699961 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9AOLPJ6UewC
Name (2,3,6,8-tetrabromodibenzo-p-dioxin-1-yl) acetate
Alternate Name(s) acetic acid (2,3,6,8-tetrabromo-1-dibenzo-p-dioxinyl) ester acetic acid (2,3,6,8-tetrabromodibenzo-p-dioxin-1-yl) ester
Comments Less than 3 mono-isotopic peaks
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Formula C14H6Br4O4
InChI InChI=1S/C14H6Br4O4/c1-5(19)20-14-11(18)7(16)4-10-13(14)22-9-3-6(15)2-8(17)12(9)21-10/h2-4H,1H3
InChIKey GGYJAXCVZVWWLY-UHFFFAOYSA-N
Molecular Weight 557.814 g/mol
SMILES c12c(Oc3c(O2)c(cc(c3)Br)Br)c(c(c(c1)Br)Br)OC(=O)C
SPLASH splash10-0a4i-0000090000-fcf2ab0ae5f9e379065e
Source of Spectrum G4-64-153-6
Wiley ID 1608768