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FTIR-ATR指纹图谱的主成分分析-马氏距离法应用于烟用香精质量控制
引用本文:王家俊,邱启杨,刘巍.FTIR-ATR指纹图谱的主成分分析-马氏距离法应用于烟用香精质量控制[J].光谱学与光谱分析,2007,27(5):895-898.
作者姓名:王家俊  邱启杨  刘巍
作者单位:1. 红河卷烟总厂产品部,云南,弥勒,652300
2. 云南烟草科学研究院烟草化学研究室,云南,昆明,650021
基金项目:红河卷烟厂科研经费资助项目
摘    要:在配制过程正常的条件下,分批采集150个三种正常烟用香精的傅里叶变换衰减全反射红外指纹图谱,并对原始数据进行均值中心化处理,同时对其光谱信号进行二阶导数基线校正和Karl Norris降噪处理,应用化学计量学中的主成分分析-马氏距离法分类建模,然后对烟用香精配制质量进行多元统计过程控制(MSPC),结果表明,将马氏距离上限的控制范围(UCL)设定在该类平均马氏距离的 3σ范围之内,均获得了正确的监控预报.

关 键 词:傅里叶变换衰减全反射红外指纹图谱  主成分分析-马氏距离分类法  多元统计过程控制  烟用香精
文章编号:1000-0593(2007)05-0895-04
收稿时间:2006-02-16
修稿时间:2006-06-28

Quality Assessment of Tobacco Flavor by Classification of Principal Component Analysis-Mahalanobis Distance Combined with FTIR-ATR Fingerprint
WANG Jia-jun,QIU Qi-yang,LIU Wei.Quality Assessment of Tobacco Flavor by Classification of Principal Component Analysis-Mahalanobis Distance Combined with FTIR-ATR Fingerprint[J].Spectroscopy and Spectral Analysis,2007,27(5):895-898.
Authors:WANG Jia-jun  QIU Qi-yang  LIU Wei
Institution:1. Products Research Centre, Honghe Cigarette Factory, Mile 652300, China ;2. Tobacco Chemistry Laboratory, Yunnan Tobacco Research Institute, Kunming 650021, China
Abstract:In normal condition, 150 Fourier transform infrared-attenuated total reflection spectra of three kinds of tobacco flavor were measured. Mean centering and Karl Norris second derivative filter were employed for treating the spectra data. Whereafter, class models of tobacco flavor were established with classification of principal component analysis-Mahalanobis distance. Class models have been applied to multivariate statistical process control(MSPC) for the quality assessment of tobacco flavor in site. The upper control limit(UCL) was based on this kind of average Mahalanobis distance within +3sigma. The results of monitoring are correct.
Keywords:FTIR-ATR fingerprint  Classification of principal component analysis-Mahalanobis distance  Multivariate statistical process control  Tobacco flavor
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