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1,6-Dibromoundecacyclo[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 IyaPzorI7xA
InChI InChI=1S/C20H18Br2/c21-19-13-3-1-2-5(13)9-10-6(2)14-4(1)8-7(3)15(19)11-12(17(9)19)18(10)20(14,22)16(8)11/h1-18H
InChIKey JTPPAJQWCSADGD-UHFFFAOYSA-N
Mol Weight 418.17 g/mol
Molecular Formula C20H18Br2
Exact Mass 415.977527 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LEWbQsW7GsL
Name 1,6-Dibromoundecacyclo[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 C20H18Br2
InChI InChI=1S/C20H18Br2/c21-19-13-3-1-2-5(13)9-10-6(2)14-4(1)8-7(3)15(19)11-12(17(9)19)18(10)20(14,22)16(8)11/h1-18H
InChIKey JTPPAJQWCSADGD-UHFFFAOYSA-N
Molecular Weight 418.172 g/mol
SMILES C12(C3C4C5C6C7C8C9C(C2C2C9C7(C7C2C1C4C67)Br)C3C58)Br
SPLASH splash10-00kr-0549600000-ec1ec4a74ac526806b79
Source of Spectrum F-53-10036-22
Wiley ID 803002