双[三(乙酰丙酮化)钛(IV)]六氯钛酸(IV)盐(12088-57-2)红外图谱(IR1)
分子式:C15H21Cl6O6Ti2-
分子量: 605.76
InChI:InChI=1S/3C5H7O2.6ClH.2Ti/c3*1-4(6)3-5(2)7;;;;;;;;/h3*3H,1-2H3;6*1H;;/q3*-1;;;;;;;2*+4/p-6
InChIKey: BTZIDZBAPWBBQQ-UHFFFAOYSA-H
Smiles:[Ti+4]([Cl-])([Cl-])([Cl-])([Cl-])([Cl-])[Cl-].CC1[CH-]C(C)=O[Ti+4]23(O=C(C)[CH-]C(C)=O2)(O=C(C)[CH-]C(C)=O3)O=1
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Parameter ppm Hz
D(A) 6.000
D(B) 2.168
Spectral Code: 1H NMR : parameter in CDCl3
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ppm Int. Assign.
191.69 136 1
108.87 850 2
25.69 1000 3
Spectral Code: 13C NMR : in CDCl3
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Spectral Code: IR : nujol mull