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(1,4-Dibromobenzene)[.eta(4).-1,5-cyclooctadiene) ruthenium
SpectraBase Compound ID IZGMIPDGrO5
InChI InChI=1S/C8H12.C6H4Br2.Ru/c1-2-4-6-8-7-5-3-1;7-5-1-2-6(8)4-3-5;/h1-2,7-8H,3-6H2;1-4H;
InChIKey SMQTVCDPSQXNAS-UHFFFAOYSA-N
Mol Weight 445.16 g/mol
Molecular Formula C14H16Br2Ru
Exact Mass 443.866217 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E9jSnWyakNL
Name (1,4-Dibromobenzene)[.eta(4).-1,5-cyclooctadiene) ruthenium
Alternate Name(s) 3,6-Dibromo-1-ruthenaspiro[hexacyclo[3.2.0.0(1,3).0(1,4).0(1,6).0(2,7)]heptane-1,1'-tetracyclo[4.3.0.0(1,5).0(2,9)]nonane]
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Formula C14H16Br2Ru
InChI InChI=1S/C8H12.C6H4Br2.Ru/c1-2-4-6-8-7-5-3-1;7-5-1-2-6(8)4-3-5;/h1-2,7-8H,3-6H2;1-4H;
InChIKey SMQTVCDPSQXNAS-UHFFFAOYSA-N
Molecular Weight 445.162 g/mol
SMILES [C@]12([Ru]3456789([C@@]1([C@]5([C@]9(Br)[C@]3([C@@]24[H])[H])[H])[H])[C@@]1(CC[C@]6([C@]7(CC[C@]81[H])[H])[H])[H])Br
SPLASH splash10-07bk-0095600000-037f2be99536efc077dc
Source of Spectrum K-130-127-4
Wiley ID 1385842