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2,2',3,3'-TETRABROMO-4,4',5,5'-TETRAHYDROXY-DIPHENYL-METHANE
SpectraBase Compound ID DnLnMXNKYc2
InChI InChI=1S/C13H8Br4O4/c14-8-4(2-6(18)12(20)10(8)16)1-5-3-7(19)13(21)11(17)9(5)15/h2-3,18-21H,1H2
InChIKey WIAKRAUTQVUHHL-UHFFFAOYSA-N
Mol Weight 547.82 g/mol
Molecular Formula C13H8Br4O4
Exact Mass 543.715611 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1nIGevk6Sop
Name 1,2-Benzenediol, 4,4'-methylenebis[5,6-dibromo-
CAS Registry Number 65487-76-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H8Br4O4
InChI InChI=1S/C13H8Br4O4/c14-8-4(2-6(18)12(20)10(8)16)1-5-3-7(19)13(21)11(17)9(5)15/h2-3,18-21H,1H2
InChIKey WIAKRAUTQVUHHL-UHFFFAOYSA-N
Molecular Weight 547.819 g/mol
SMILES Oc1cc(c(c(c1O)Br)Br)Cc1c(c(Br)c(c(c1)O)O)Br
SPLASH splash10-052k-0018090000-a6e424bd8d46a64d6914
Source of Spectrum SB-33-108-0
Synonyms 3,4-Dibromo-5-(2,3-dibromo-4,5-dihydroxy-benzyl)pyrocatechol 3,4-Dibromo-5-[(2,3-dibromo-4,5-dihydroxy-phenyl)methyl]benzene-1,2-diol 5-[[2,3-bis(bromanyl)-4,5-bis(oxidanyl)phenyl]methyl]-3,4-bis(bromanyl)benzene-1,2-diol
Wiley ID 1404975