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Diiodo{2,2'-dithiobis(6-tert-butyl-4-methylphenolato)}titanium
SpectraBase Compound ID LuW9HPEiOt8
InChI InChI=1S/C22H30O2S2.2HI.Ti/c1-13-9-15(21(3,4)5)19(23)17(11-13)25-26-18-12-14(2)10-16(20(18)24)22(6,7)8;;;/h9-12,23-24H,1-8H3;2*1H;/q;;;+4/p-4
InChIKey ALGDTBIYULMIEX-UHFFFAOYSA-J
Mol Weight 690.26 g/mol
Molecular Formula C22H28I2O2S2Ti
Exact Mass 689.909953 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID pPASgIR8jG
Name Diiodo{2,2'-dithiobis(6-tert-butyl-4-methylphenolato)}titanium
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Formula C22H28I2O2S2Ti
InChI InChI=1S/C22H30O2S2.2HI.Ti/c1-13-9-15(21(3,4)5)19(23)17(11-13)25-26-18-12-14(2)10-16(20(18)24)22(6,7)8;;;/h9-12,23-24H,1-8H3;2*1H;/q;;;+4/p-4
InChIKey ALGDTBIYULMIEX-UHFFFAOYSA-J
Molecular Weight 690.260 g/mol
SMILES c1(SSc2c(c(cc(c2)C)C(C)(C)C)[O-])cc(cc(c1[O-])C(C)(C)C)C.[Ti+4].[I-].[I-]
SPLASH splash10-002r-0801910000-24b1fe63fee0746ee715
Source of Spectrum U2-2000-1324-3
Synonyms Titanium(IV) 6,6'-disulfanediylbis(2-(tert-butyl)-4-methylphenolate) diiodide
Wiley ID 1790865