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Dimethylgallium (2,4-di-tert-butyl-6-((Z)-(((1R,2R)-2-((E)-(3,5-di-tert-butyl-2-oxidobenzylidene)amino)cyclohexyl)imino)methyl)phenoxy)triisopropoxytitanium
SpectraBase Compound ID FMsxYBofFbI
InChI InChI=1S/C36H54N2O2.3C3H7O.2CH3.Ga.Ti/c1-33(2,3)25-17-23(31(39)27(19-25)35(7,8)9)21-37-29-15-13-14-16-30(29)38-22-24-18-26(34(4,5)6)20-28(32(24)40)36(10,11)12;3*1-3(2)4;;;;/h17-22,29-30,39-40H,13-16H2,1-12H3;3*3H,1-2H3;2*1H3;;/q;3*-1;;;+1;+4/p-2/b37-21-,38-22+;;;;;;;/t29-,30-;;;;;;;/m1......./s1
InChIKey APSNGSZBAKBAFH-MMDZTTKBSA-L
Mol Weight 869.7 g/mol
Molecular Formula C47H79GaN2O5Ti
Exact Mass 868.472413 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KKJm1dh1GgK
Name Dimethylgallium (2,4-di-tert-butyl-6-((Z)-(((1R,2R)-2-((E)-(3,5-di-tert-butyl-2-oxidobenzylidene)amino)cyclohexyl)imino)methyl)phenoxy)triisopropoxytitanium
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Formula C47H79GaN2O5Ti
InChI InChI=1S/C36H54N2O2.3C3H7O.2CH3.Ga.Ti/c1-33(2,3)25-17-23(31(39)27(19-25)35(7,8)9)21-37-29-15-13-14-16-30(29)38-22-24-18-26(34(4,5)6)20-28(32(24)40)36(10,11)12;3*1-3(2)4;;;;/h17-22,29-30,39-40H,13-16H2,1-12H3;3*3H,1-2H3;2*1H3;;/q;3*-1;;;+1;+4/p-2/b37-21-,38-22+;;;;;;;/t29-,30-;;;;;;;/m1......./s1
InChIKey APSNGSZBAKBAFH-MMDZTTKBSA-L
Literature Reference DOI 10.1002/adsc.200800767
Molecular Weight 869.748 g/mol
SMILES c1(cc(C(C)(C)C)cc(C(C)(C)C)c1O[Ga](C)C)\C=N\[C@]1([C@@](CCCC1)(\N=C/c1cc(cc(C(C)(C)C)c1O[Ti](OC(C)C)(OC(C)C)OC(C)C)C(C)(C)C)[H])[H]
SPLASH splash10-03di-1000009010-dbc3fcdaadaa86b82d2e
Source of Spectrum ASC-351-920/SM3-8
Wiley ID 1766484