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67
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77950215159
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70
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0009706578
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The KIE is of prime importance in the modeling of partially deuterated compounds, because the labeling can decisively influence the selectivities via an effect known as isotopically sensitive branching, see
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The KIE is of prime importance in the modeling of partially deuterated compounds, because the labeling can decisively influence the selectivities via an effect known as isotopically sensitive branching, see: A. Thibblin, J. Phys. Org. Chem. 1998, 11, 161-1.67.
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For mass spectrometric techniques that permit the detection of neutral products, see
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For the concept of such kinetic modelings of complex isotope distribution patterns with several competing channels, see: a
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In addition to the assumption of KIE = 2.1 for the initial C-H(D) bond activation, the model applied the following specific parameters in the best fit which can reproduce the relative abundances listed in Table1 and Table 2 within an error ±2 in the branching ratios;
-
In addition to the assumption of KIE = 2.1 for the initial C-H(D) bond activation, the model applied the following specific parameters in the best fit which can reproduce the relative abundances listed in Table1 and Table 2 within an error ±2 in the branching ratios;
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103
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+, respectively;
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+, respectively;
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104
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77950261849
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The optimized branch-ing for the formation of propyl cation is obtained with 95 % H(D)abstraction from the C(2) position, as also expected intuitively
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d) The optimized branch-ing for the formation of propyl cation is obtained with 95 % H(D)abstraction from the C(2) position, as also expected intuitively;
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