Title :
Quantitative determination of cyfluthrin in n-hexane by terahertz time-domain spectroscopy with chemometrics methods
Author :
Yuefang Hua ; Hongjian Zhang ; Hongliang Zhou
Author_Institution :
Dept. of Control Sci. & Eng., Zhejiang Univ., Hangzhou, China
Abstract :
Terahertz time-domain spectroscopy (THz-TDS) was used for the detection of cyfluthrin content in N-hexane solvent with the concentration range of 0.5-10 μg/mL. The absorbance of the solution form cyfluthrin was obtained in the frequency range between 0.5-1.5 THz. Two kinds of multivariate linear regression models were then built between the absorbance and the concentration of 15 samples, using partial least squares (PLS) and principle component regression (PCR) methods. The number of factors leading to the least root-mean-square error of cross validation (RMSECV) was 2 for PCR and 9 for PLS respectively. Compared to the PCR model, the PLS model proves to be more effective, with the RMSECV as low as 0.565 μg/mL. Results show that the THz-TDS plus PLS method is very promising for the further pesticide residue detection in food safety control, with the characteristics of being nondestructive and laborsaving compared to other analytical tools.
Keywords :
agrochemicals; chemical analysis; mean square error methods; organic compounds; regression analysis; terahertz spectroscopy; N-hexane solvent; chemometrics method; cyfluthrin content detection; frequency 0.5 THz to 1.5 THz; least root-mean-square error; multivariate linear regression model; partial least square method; principle component regression method; terahertz time-domain spectroscopy; Chemical technology; Frequency domain analysis; Infrared spectra; Least squares methods; Linear regression; Safety; Solvents; Spectroscopy; Submillimeter wave technology; Time domain analysis; Cyfluthrin; Partial least squares (PLS); Principle component regression (PCR); Quantitative; Terahertz time-domain spectroscopy (THz-TDS);
Conference_Titel :
Instrumentation and Measurement Technology Conference, 2009. I2MTC '09. IEEE
Conference_Location :
Singapore
Print_ISBN :
978-1-4244-3352-0
DOI :
10.1109/IMTC.2009.5168534