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DICHLORO-[1,4-DITHIABUTANEDIYL-2,2'-BIS-(4,6-DI-TERT.-BUTYLPHENOXY)]-TITANIUM
SpectraBase Compound ID AFi70DXWbgJ
InChI InChI=1S/C30H46O2S2.2ClH.Ti/c1-27(2,3)19-15-21(29(7,8)9)25(31)23(17-19)33-13-14-34-24-18-20(28(4,5)6)16-22(26(24)32)30(10,11)12;;;/h15-18,31-32H,13-14H2,1-12H3;2*1H;/q;;;+4/p-4
InChIKey PXYFZJMXDVLELZ-UHFFFAOYSA-J
Mol Weight 619.6 g/mol
Molecular Formula C30H44Cl2O2S2Ti
Exact Mass 618.163919 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1S52eisBnWV
Name DICHLORO-[1,4-DITHIABUTANEDIYL-2,2'-BIS-(4,6-DI-TERT.-BUTYLPHENOXY)]-TITANIUM
Compound Number 2A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H44Cl2O2S2Ti
InChI InChI=1S/C30H46O2S2.2ClH.Ti/c1-27(2,3)19-15-21(29(7,8)9)25(31)23(17-19)33-13-14-34-24-18-20(28(4,5)6)16-22(26(24)32)30(10,11)12;;;/h15-18,31-32H,13-14H2,1-12H3;2*1H;/q;;;+4/p-4
InChIKey PXYFZJMXDVLELZ-UHFFFAOYSA-J
Literature Reference Author C.CAPACCHIONE,A.PROTO,H.EBELING,R.MUEHAUPT,K.MOELLER,T.P.SPA NIOL,J.OKUDA
Literature Reference Citation J.AM.CHEM.SOC.,125,4964(2003)
Literature Reference DOI 10.1021/ja029968g
Molecular Weight 619.584 g/mol
Sample ID 40924
Solvent CD2Cl2