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3,3'-Dibromo-6,6'-butylenedioxy-2,2'-biphenyldiol
SpectraBase Compound ID B2d4UN7BADM
InChI InChI=1S/C16H14Br2O4/c17-9-3-5-11-13(15(9)19)14-12(6-4-10(18)16(14)20)22-8-2-1-7-21-11/h3-6,19-20H,1-2,7-8H2
InChIKey KXUKLHJKAGZCHX-UHFFFAOYSA-N
Mol Weight 430.09 g/mol
Molecular Formula C16H14Br2O4
Exact Mass 427.925885 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BiVMCPHioB5
Name 3,3'-Dibromo-6,6'-butylenedioxy-2,2'-biphenyldiol
Alternate Name(s) (S)-3,3'-Dibromo-6,6'-butylenedioxy-2,2'-biphenyldiol 2,13-dibromo-6,7,8,9-tetrahydrodibenzo[b,d][1,6]dioxecin-1,14-diol
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Formula C16H14Br2O4
InChI InChI=1S/C16H14Br2O4/c17-9-3-5-11-13(15(9)19)14-12(6-4-10(18)16(14)20)22-8-2-1-7-21-11/h3-6,19-20H,1-2,7-8H2
InChIKey KXUKLHJKAGZCHX-UHFFFAOYSA-N
Molecular Weight 430.092 g/mol
SMILES Oc1c2-c3c(c(ccc3OCCCCOc2ccc1Br)Br)O
SPLASH splash10-003r-0002900000-9cc7677ade344f2fb82c
Source of Spectrum F-53-16675-17
Wiley ID 804583