光谱学与光谱分析
光譜學與光譜分析
광보학여광보분석
SPECTROSCOPY AND SPECTRAL ANALYSIS
2014年
10期
2623-2626
,共4页
赵安新%汤晓君%张钟华%刘君华
趙安新%湯曉君%張鐘華%劉君華
조안신%탕효군%장종화%류군화
二维相关光谱%傅里叶变换红外光谱%谱分辨率增强%同分子异构体%多组分混合气体定量分析
二維相關光譜%傅裏葉變換紅外光譜%譜分辨率增彊%同分子異構體%多組分混閤氣體定量分析
이유상관광보%부리협변환홍외광보%보분변솔증강%동분자이구체%다조분혼합기체정량분석
Two-dimensional correlation spectroscopy%Fourier transform infrared spectroscopy%Spectral resolution enhance-ment%Alkane isomers%M ulti-component gas quantitative analysis
在利用傅里叶变换红外光谱进行混合气体定量分析中,针对烃类尤其是同分异构体等构成的混合气体其谱图特征相似、吸收峰严重交叠,不易进行特征吸收成分的判别和特征变量选择的问题,为增强谱峰分辨力,采用广义二维相关光谱和傅里叶变化红外光谱对烃类混合气体分析中同分异构体进行辨别,以异丁烷和正丁烷的红外光谱及受浓度扰动组成的光谱组为例进行二维相关红外光谱分析。通过观察全波段和主吸收峰波段单组分气体的傅里叶变换红外光谱,可知其谱图相似,吸收峰严重交叠,如果混合在一起,将基本无法辨别何种分子结构及成分。通过广义二维相关光谱的变换,其二维相关光谱的同步谱和异步谱可以清晰地辨别出异丁烷和正丁烷的特征吸收峰及其各自强度,实验结果可知,异丁烷在2893,2954和2977 cm -1,正丁烷在2895和2965 cm -1具有强的吸收特征谱线。分析结果初步验证了二维红外相关光谱在多组分混合气体傅里叶变换红外光谱定量分析中谱分辨率增强方面的应用。
在利用傅裏葉變換紅外光譜進行混閤氣體定量分析中,針對烴類尤其是同分異構體等構成的混閤氣體其譜圖特徵相似、吸收峰嚴重交疊,不易進行特徵吸收成分的判彆和特徵變量選擇的問題,為增彊譜峰分辨力,採用廣義二維相關光譜和傅裏葉變化紅外光譜對烴類混閤氣體分析中同分異構體進行辨彆,以異丁烷和正丁烷的紅外光譜及受濃度擾動組成的光譜組為例進行二維相關紅外光譜分析。通過觀察全波段和主吸收峰波段單組分氣體的傅裏葉變換紅外光譜,可知其譜圖相似,吸收峰嚴重交疊,如果混閤在一起,將基本無法辨彆何種分子結構及成分。通過廣義二維相關光譜的變換,其二維相關光譜的同步譜和異步譜可以清晰地辨彆齣異丁烷和正丁烷的特徵吸收峰及其各自彊度,實驗結果可知,異丁烷在2893,2954和2977 cm -1,正丁烷在2895和2965 cm -1具有彊的吸收特徵譜線。分析結果初步驗證瞭二維紅外相關光譜在多組分混閤氣體傅裏葉變換紅外光譜定量分析中譜分辨率增彊方麵的應用。
재이용부리협변환홍외광보진행혼합기체정량분석중,침대경류우기시동분이구체등구성적혼합기체기보도특정상사、흡수봉엄중교첩,불역진행특정흡수성분적판별화특정변량선택적문제,위증강보봉분변력,채용엄의이유상관광보화부리협변화홍외광보대경류혼합기체분석중동분이구체진행변별,이이정완화정정완적홍외광보급수농도우동조성적광보조위례진행이유상관홍외광보분석。통과관찰전파단화주흡수봉파단단조분기체적부리협변환홍외광보,가지기보도상사,흡수봉엄중교첩,여과혼합재일기,장기본무법변별하충분자결구급성분。통과엄의이유상관광보적변환,기이유상관광보적동보보화이보보가이청석지변별출이정완화정정완적특정흡수봉급기각자강도,실험결과가지,이정완재2893,2954화2977 cm -1,정정완재2895화2965 cm -1구유강적흡수특정보선。분석결과초보험증료이유홍외상관광보재다조분혼합기체부리협변환홍외광보정량분석중보분변솔증강방면적응용。
The generalized two-dimensional correlation spectroscopy and Fourier transform infrared were used to identify hydro-carbon isomers in the mixed gases for absorption spectra resolution enhancement .The Fourier transform infrared spectrum of n-butane and iso-butane and the two-dimensional correlation infrared spectrum of concentration perturbation were used for analysis as an example .The all band and the main absorption peak wavelengths of Fourier transform infrared spectrum for single compo-nent gas showed that the spectra are similar ,and if they were mixed together ,absorption peaks overlap and peak is difficult to i-dentify .The synchronous and asynchronous spectrum of two-dimensional correlation spectrum can clearly identify the iso-butane and normal butane and their respective characteristic absorption peak intensity .Iso-butane has strong absorption characteristics spectrum lines at 2 893 ,2 954 and 2 893 cm -1 ,and n-butane at 2 895 and 2 965 cm -1 .The analysis result in this paper prelimi-nary verified that the two-dimensional infrared correlation spectroscopy can be used for resolution enhancement in Fourier trans-form infrared spectrum quantitative analysis .