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4b,8b,12b,16b-Tetrabromo-4b,8b,12b,16b-tetrahydrodibenzo[a,f]dibenzo[2,3:4,5]pentaleno[1,6-cd]pentalene (Tetrabromofenestrindane)
SpectraBase Compound ID J10V4wBZTuX
InChI InChI=1S/C29H16Br4/c30-25-17-9-1-2-10-18(17)26(31)21-13-5-6-14-22(21)28(33)24-16-8-7-15-23(24)27(32,29(25,26)28)20-12-4-3-11-19(20)25/h1-16H/t25-,26-,27+,28+,29?
InChIKey BUCRMFAQEBBZSK-YEROFDESSA-N
Mol Weight 684.06 g/mol
Molecular Formula C29H16Br4
Exact Mass 679.798553 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K3Of1zQXgU3
Name 4b,8b,12b,16b-Tetrabromo-4b,8b,12b,16b-tetrahydrodibenzo[a,f]dibenzo[2,3:4,5]pentaleno[1,6-cd]pentalene (Tetrabromofenestrindane)
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Formula C29H16Br4
InChI InChI=1S/C29H16Br4/c30-25-17-9-1-2-10-18(17)26(31)21-13-5-6-14-22(21)28(33)24-16-8-7-15-23(24)27(32,29(25,26)28)20-12-4-3-11-19(20)25/h1-16H/t25-,26-,27+,28+,29?
InChIKey BUCRMFAQEBBZSK-YEROFDESSA-N
Molecular Weight 684.063 g/mol
SMILES C123[C@]4(c5ccccc5[C@]3(c3ccccc3[C@@]1(c1ccccc1[C@]2(c1ccccc41)Br)Br)Br)Br
SPLASH splash10-0nmi-0009327000-6f9b7fe1320d9055ae6a
Source of Spectrum KC-0-730-19
Synonyms 4b,8b,12b,16b-tetrabromo-4b,8b,12b,16b-tetrahydrodibenzo[a,f]dibenzo[2,3:4,5]pentaleno[1,6-cd]pentalene
Wiley ID 783311