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(DMSC)-TI-[OC(PARA-MEC6H4)2C2-TERT.-BUTYL-H]
SpectraBase Compound ID HtQDZPQ8qbE
InChI InChI=1S/C46H60O4Si.C21H24O.Ti/c1-43(2,3)35-19-27-15-28-20-36(44(4,5)6)22-30(40(28)48)17-32-24-38(46(10,11)12)26-34-18-33-25-37(45(7,8)9)23-31(16-29(21-35)39(27)47)41(33)49-51(13,14)50-42(32)34;1-16-6-10-18(11-7-16)21(22,15-14-20(3,4)5)19-12-8-17(2)9-13-19;/h19-26,47-48H,15-18H2,1-14H3;6-13,15H,1-5H3;/q;-1;+3/p-2
InChIKey MCMIEPICGUAURW-UHFFFAOYSA-L
Mol Weight 1043.3 g/mol
Molecular Formula C67H82O5SiTi
Exact Mass 1042.541093 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 21oezs8g4nK
Name (DMSC)-TI-[OC(PARA-MEC6H4)2C2-TERT.-BUTYL-H]
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C67H82O5SiTi
InChI InChI=1S/C46H60O4Si.C21H24O.Ti/c1-43(2,3)35-19-27-15-28-20-36(44(4,5)6)22-30(40(28)48)17-32-24-38(46(10,11)12)26-34-18-33-25-37(45(7,8)9)23-31(16-29(21-35)39(27)47)41(33)49-51(13,14)50-42(32)34;1-16-6-10-18(11-7-16)21(22,15-14-20(3,4)5)19-12-8-17(2)9-13-19;/h19-26,47-48H,15-18H2,1-14H3;6-13,15H,1-5H3;/q;-1;+3/p-2
InChIKey MCMIEPICGUAURW-UHFFFAOYSA-L
Literature Reference Author J.V.KINGSTON,O.V.OZEROV,S.PARKIN,C.P.BROCK,F.T.LADIPO
Literature Reference Citation J.AM.CHEM.SOC.,124,12217(2002)
Literature Reference DOI 10.1021/ja0271577
Molecular Weight 1043.351 g/mol
Sample ID 47620
Solvent C6D6