![bis[2,2'-methylene bis(6-t-butyl)-4-methylphenoxy0]titanium](/api/spectrum/2d9iBgm736s/structure.png?h=300&w=458 "bis[2,2'-methylene bis(6-t-butyl)-4-methylphenoxy0]titanium")
| SpectraBase Compound ID | BrCw6GvvVFh |
|---|---|
| InChI | InChI=1S/2C23H32O2.Ti/c2*1-14-9-16(20(24)18(11-14)22(3,4)5)13-17-10-15(2)12-19(21(17)25)23(6,7)8;/h2*9-12,24-25H,13H2,1-8H3;/q;;+4/p-4 |
| InChIKey | GGMGCEIRCXMXEO-UHFFFAOYSA-J |
| Mol Weight | 724.8 g/mol |
| Molecular Formula | C46H60O4Ti |
| Exact Mass | 724.397101 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 2d9iBgm736s |
|---|---|
| Name | bis[2,2'-methylene bis(6-t-butyl)-4-methylphenoxy0]titanium |
| Alternate Name(s) | 7,7',13,13'-tetra-tert-butyl-5,5',15,15'-tetramethyl-9,9',11,11'-tetraoxa-10-titana-10,10'-spirobi[tricyclo[10.4.0.0(3,8)]hexadecane]-1(12),1'(12'),3,3',5,5',7,7',13,13',15,15'-dodecaene |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C46H60O4Ti |
| InChI | InChI=1S/2C23H32O2.Ti/c2*1-14-9-16(20(24)18(11-14)22(3,4)5)13-17-10-15(2)12-19(21(17)25)23(6,7)8;/h2*9-12,24-25H,13H2,1-8H3;/q;;+4/p-4 |
| InChIKey | GGMGCEIRCXMXEO-UHFFFAOYSA-J |
| Molecular Weight | 724.849 g/mol |
| SMILES | c12O[Ti]3(Oc4c(Cc2cc(cc1C(C)(C)C)C)cc(cc4C(C)(C)C)C)Oc1c(cc(cc1C(C)(C)C)C)Cc1c(O3)c(C(C)(C)C)cc(C)c1 |
| SPLASH | splash10-00di-2000000900-a89900a2c40faa27a357 |
| Source of Spectrum | K-128-226-0 |
| Wiley ID | 1415756 |