4-(Methylnitrosamino)-1-(3-pyridyl)-1-butanone, a Nicotine-derived Carcinogenic Nitrosaminoketone (NNK): Three-dimensional Structure

被引：0
|
作者：
Amy K. Katz
H. L. Carrell
Carol E. Afshar
Jenny P. Glusker
Dhimant Desai
Shantu Amin
机构：
[1] The Institute for Cancer Research,Fox Chase Cancer Center
[2] American Health Foundation,undefined
来源：
Structural Chemistry | 1999年 / 10卷
关键词：
Nicotine-derived nitrosaminoketone; nitrosamine; crystal structure; molecular dimensions;
D O I：
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学科分类号：
摘要：
The three-dimensional structure of the carcinogenic nicotine-derived nitrosaminoketone, 4-(methyl-nitrosamino)-l-(3-pyridyl)-l-butanone, has been determined by X-ray crystallographic techniques. The molecule is essentially planar except for the methylnitrosamine group which is oriented at a dihedral angle of 68.7° to the pyridine ring. Molecules pack by way of —H⋯O interactions that involve the —NNO group.
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页码：439 / 443
页数：4
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