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Bis(eta5-tert-butylcyclopentadienyl)-cis-1,2-ethendithiolatotitan(IV)
SpectraBase Compound ID 2ArAr9DSzP0
InChI InChI=1S/2C9H13.C2H4S2.Ti/c2*1-9(2,3)8-6-4-5-7-8;3-1-2-4;/h2*4-7H,1-3H3;1-4H;/q2*-1;;+4/p-2/b;;2-1-;
InChIKey YLBPNLZJBGUKHF-KWZUVTIDSA-L
Mol Weight 380.43 g/mol
Molecular Formula C20H28S2Ti
Exact Mass 380.111184 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CY6LyjS0FCA
Name Bis(eta5-tert-butylcyclopentadienyl)-cis-1,2-ethendithiolatotitan(IV)
Alternate Name(s) titanium(IV) (Z)-ethene-1,2-bis(thiolate) bis(1-(tert-butyl)cyclopenta-2,4-dien-1-ide)
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Formula C20H28S2Ti
InChI InChI=1S/2C9H13.C2H4S2.Ti/c2*1-9(2,3)8-6-4-5-7-8;3-1-2-4;/h2*4-7H,1-3H3;1-4H;/q2*-1;;+4/p-2/b;;2-1-;
InChIKey YLBPNLZJBGUKHF-KWZUVTIDSA-L
Molecular Weight 380.431 g/mol
SMILES c1c[c-](cc1)C(C)(C)C.[S-]\C=C/[S-].[Ti+4].c1c[c-](cc1)C(C)(C)C
SPLASH splash10-0a4i-0092000000-81f9a4111a702d33f8c0
Source of Spectrum DZ-620-1809-2a
Wiley ID 1797824