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1,3,15-Tribromoundecacyclo[9.9.0.0(2,9).0(3,7).0(4,20).0(5,18).0(6,16).0(8,15).0(10,14).0(12,19).0(13,17)]icosane
SpectraBase Compound ID 1zcxR2MPdQl
InChI InChI=1S/C20H17Br3/c21-18-10-2-1-3-6-5(2)11(18)8-9-16(18)15-7(10)4(1)14-13(3)19(22,12(6)8)17(9)20(14,15)23/h1-17H/t1-,2+,3+,4+,5+,6+,7+,8-,9+,10-,11-,12+,13-,14+,15-,16-,17-,18+,19+,20+/m1/s1
InChIKey HZGXMBRULLFRCE-UHFFFAOYSA-N
Mol Weight 497.07 g/mol
Molecular Formula C20H17Br3
Exact Mass 493.88804 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2M14c7mXFg
Name 1,3,15-Tribromoundecacyclo[9.9.0.0(2,9).0(3,7).0(4,20).0(5,18).0(6,16).0(8,15).0(10,14).0(12,19).0(13,17)]icosane
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Formula C20H17Br3
InChI InChI=1S/C20H17Br3/c21-18-10-2-1-3-6-5(2)11(18)8-9-16(18)15-7(10)4(1)14-13(3)19(22,12(6)8)17(9)20(14,15)23/h1-17H/t1-,2+,3+,4+,5+,6+,7+,8-,9+,10-,11-,12+,13-,14+,15-,16-,17-,18+,19+,20+/m1/s1
InChIKey HZGXMBRULLFRCE-UHFFFAOYSA-N
Molecular Weight 497.068 g/mol
SMILES [C@]12([C@]3([C@@]4([C@@]5([C@@]6([C@]3([C@]3([C@]7([C@@]6([C@]6([C@]8([C@@]7([C@@]([C@@]23[H])([C@]2([C@]1([C@]4([C@]([C@]56[H])([C@@]82[H])[H])[H])[H])[H])[H])[H])[H])[H])[H])Br)[H])[H])[H])[H])Br)[H])Br
SPLASH splash10-014i-0764900000-66f8b59aab40f04f967a
Source of Spectrum KC-0-1205-38
Synonyms 1,3,14-tribromoundecacyclo[9.9.0.0(2,9).0(3,7).0(4,20).0(5,18).0(6,16).0(8,15).0(10,14).0(12,19).0(13,17)]icosane
Wiley ID 825172