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1-[2'-Trimethylsilylethyn-1'-yl]-2-(6'-t-butylhexa-1',3',5'-triyn-1'-yl] tricarbonyl(cyclobutadiene)iron complexe
SpectraBase Compound ID Gn58zHk1wXp
InChI InChI=1S/C19H20Si.3CO.Fe/c1-19(2,3)15-10-8-7-9-11-17-12-13-18(17)14-16-20(4,5)6;3*1-2;/h12-13H,1-6H3;;;;
InChIKey AXBQCGRKOPSKND-UHFFFAOYSA-N
Mol Weight 416.33 g/mol
Molecular Formula C22H20FeO3Si
Exact Mass 416.053107 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LZWRioiDsaB
Name 1-[2'-Trimethylsilylethyn-1'-yl]-2-(6'-t-butylhexa-1',3',5'-triyn-1'-yl] tricarbonyl(cyclobutadiene)iron complexe
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Formula C22H20FeO3Si
InChI InChI=1S/C19H20Si.3CO.Fe/c1-19(2,3)15-10-8-7-9-11-17-12-13-18(17)14-16-20(4,5)6;3*1-2;/h12-13H,1-6H3;;;;
InChIKey AXBQCGRKOPSKND-UHFFFAOYSA-N
Molecular Weight 416.329 g/mol
SMILES [C@@]12([Fe]34([C@@]2([C@]4([C@@]13C#CC#CC#CC(C)(C)C)[H])[H])(C#[O])(C#[O])C#[O])C#C[Si](C)(C)C
SPLASH splash10-001i-0009000000-7ebc47bf9dd741803e37
Source of Spectrum K-129-793-6
Synonyms {2-[3-(7,7-dimethylocta-1,3,5-triyn-1-yl)-1,1,1-tris(hydroxymethyl)-1-ferratetracyclo[2.1.0.0(1,3).0(2,5)]pentan-2-yl]ethynyl}trimethylsilane
Wiley ID 1376286