公开(公告)号：US09134227B2

公开(公告)日：2015-09-15

申请号：US13504977

申请日：2010-10-21

申请人： Leslie Joseph Janik ,  Andreas Paul Loibner ,  Juergen Kattner ,  Eva Edelmann

发明人： Leslie Joseph Janik ,  Andreas Paul Loibner ,  Juergen Kattner ,  Eva Edelmann

IPC分类号： G01J5/02 ,  G01N21/3563 ,  G01N21/27 ,  G01N21/31 ,  G01N21/93 ,  G01N21/3504 ,  G01N21/3577 ,  G01N21/359 ,  G01N21/552 ,  G01N21/35

CPC分类号： G01N21/3563 ,  G01N21/274 ,  G01N21/314 ,  G01N21/3504 ,  G01N21/3577 ,  G01N21/359 ,  G01N21/552 ,  G01N21/93 ,  G01N2021/3133 ,  G01N2021/3155 ,  G01N2021/3595 ,  G01N2201/1293

摘要： Method for determining polycyclic aromatic hydrocarbon (PAH) concentration in a solid state sample. The method includes exposing the sample to diffuse reflectance infrared spectroscopy, recording at least one spectroscopic parameter of infrared diffuse reflection of the sample, which is a signal obtained at one or more frequencies within a range of frequencies (+/−10 cm−1) selected from the group consisting of 3000-3100 cm−1, 740, 777, 814, 842, 1430, 1510, 1600, 4055-4056, 4642-4646, 5924, and 5951-5953 cm−1, and performing data analysis by correlating the at least one spectroscopic parameter with variables of a trained multivariate calibration model related to PAH concentrations, thereby determining PAH concentrations in the sample.

摘要翻译： 确定固态样品中多环芳烃（PAH）浓度的方法。 该方法包括将样品暴露于漫反射红外光谱，记录样品的红外漫反射的至少一个光谱参数，该频谱参数是在频率范围（+/- 10cm -1）内以一个或多个频率获得的信号， 选自3000-3100cm-1,740,777,814,842,1430,1510,1600,4055-4056,4642-4646,5924和5951-5953cm-1，并且通过以下步骤进行数据分析： 将至少一个光谱参数与与PAH浓度相关的经训练的多变量校准模型的变量相关联，从而确定样品中的PAH浓度。

公开(公告)号：US20120318982A1

公开(公告)日：2012-12-20

申请号：US13504977

申请日：2010-10-21

申请人： Leslie Joseph Janik ,  Andreas Paul Loibner ,  Juergen Kattner ,  Eva Edelmann

发明人： Leslie Joseph Janik ,  Andreas Paul Loibner ,  Juergen Kattner ,  Eva Edelmann

IPC分类号： G01J3/42

CPC分类号： G01N21/3563 ,  G01N21/274 ,  G01N21/314 ,  G01N21/3504 ,  G01N21/3577 ,  G01N21/359 ,  G01N21/552 ,  G01N21/93 ,  G01N2021/3133 ,  G01N2021/3155 ,  G01N2021/3595 ,  G01N2201/1293

摘要： The invention refers to the use of a device for determining PAH concentration in a solid state sample, which device comprises a) means for exposing the sample to diffuse reflectance infrared spectroscopy, b) detecting means for recording at least one spectroscopic parameter of infrared diffuse reflection of said sample, which is a signal obtained at one or more frequencies within a range of frequencies (+/−10 cm−1) selected from the group consisting of 3000-3100 cm−1, 740, 777, 814, 842, 1430, 1510, 1600, 4055-4056, 4642-4646, 5924, and 5951-5953 cm−1, and c) computing means for performing data analysis by correlating the at least one spectroscopic parameter with variables of a trained multivariate calibration model related to PAH concentrations, thereby obtaining prediction of PAH concentrations in the sample, and a method of determining a PAH concentration by diffuse reflectance infrared spectroscopy.

摘要翻译： 本发明涉及用于测定固体样品中PAH浓度的装置，该装置包括：a）将样品暴露于漫反射红外光谱的装置，b）用于记录红外漫反射的至少一个光谱参数的检测装置 所述样本是在选自3000-3100cm -1，740,777,814,842,1430的频率（+/- 10cm -1）范围内的一个或多个频率处获得的信号 ，1510,1600,4055-4056,4642-4646,5924和5951-5953cm-1，以及c）用于通过将所述至少一个光谱参数与经训练的多变量校准模型的变量相关联来执行数据分析的计算装置 PAH浓度，从而获得样品中PAH浓度的预测，以及通过漫反射红外光谱法测定PAH浓度的方法。