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1,2,16-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 IgQO59f22jt
InChI InChI=1S/C20H17Br3/c21-18-11-1-3-4-2(11)6-8-15(4)19(22)14(3)7-5(1)12(18)9-10(13(6)18)17(8)20(19,23)16(7)9/h1-17H
InChIKey GGSVEOWINQPOND-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 JOlNmriXCRw
Name 1,2,16-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/c21-18-11-1-3-4-2(11)6-8-15(4)19(22)14(3)7-5(1)12(18)9-10(13(6)18)17(8)20(19,23)16(7)9/h1-17H
InChIKey GGSVEOWINQPOND-UHFFFAOYSA-N
Molecular Weight 497.068 g/mol
SMILES C12(C3(C4C5C6C3C3C1C1C7C8C(Br)(C6C37)C5C3C4C2C1C83)Br)Br
SPLASH splash10-0ab9-8290500000-6d98eca62bc296a279d1
Source of Spectrum QE-12-6251-31
Wiley ID 1587210