Chem. J. Chinese Universities ›› 2015, Vol. 36 ›› Issue (9): 1667.doi: 10.7503/cjcu20150228
• Analytical Chemistry • Previous Articles Next Articles
XU Buyi1,2, YE Yi1, RUAN Ruoyun1, YAN Youyi1, LIAO Linchuan1,*()
Received:
2015-03-25
Online:
2015-09-10
Published:
2015-08-17
Contact:
LIAO Linchuan
E-mail:linchuanliao@scu.edu.cn
Supported by:
CLC Number:
TrendMD:
XU Buyi, YE Yi, RUAN Ruoyun, YAN Youyi, LIAO Linchuan. Determination of Illegal Drugs in Urine Using Excitation-emission Matrix Fluorescence Coupled with Second-order Calibration†[J]. Chem. J. Chinese Universities, 2015, 36(9): 1667.
No. | Concentration/(mg·L-1) | No. | Concentration/(mg·L-1) | ||||||
---|---|---|---|---|---|---|---|---|---|
MA | MDMA | COC | MOR | MA | MDMA | COC | MOR | ||
1# | 2.0 | 0.03 | 0.4 | 2.5 | 9# | 18.0 | 0.05 | 0.3 | 0.5 |
2# | 4.0 | 0.06 | 0.8 | 5.0 | 10# | 20.0 | 0.08 | 0.7 | 3.0 |
3# | 6.0 | 0.09 | 0.1 | 2.0 | 11# | 4.0 | 0.03 | 0.4 | 4.0 |
4# | 8.0 | 0.01 | 0.5 | 4.5 | 12# | 6.0 | 0.06 | 0.8 | 3.5 |
5# | 10.0 | 0.04 | 0.9 | 1.5 | 13# | 8.0 | 0.08 | 0.3 | 3.0 |
6# | 12.0 | 0.07 | 0.2 | 4.0 | 14# | 12.0 | 0.02 | 0.7 | 2.0 |
7# | 14.0 | 0.1 | 0.6 | 1.0 | 15# | 14.0 | 0.04 | 0.2 | 1.5 |
8# | 16.0 | 0.02 | 1.0 | 3.5 | 16# | 16.0 | 0.07 | 0.6 | 1.0 |
Table 1 Concentrations of four illegal drugs in the calibration(1#—10#) and prediction(11#—16#) samples
No. | Concentration/(mg·L-1) | No. | Concentration/(mg·L-1) | ||||||
---|---|---|---|---|---|---|---|---|---|
MA | MDMA | COC | MOR | MA | MDMA | COC | MOR | ||
1# | 2.0 | 0.03 | 0.4 | 2.5 | 9# | 18.0 | 0.05 | 0.3 | 0.5 |
2# | 4.0 | 0.06 | 0.8 | 5.0 | 10# | 20.0 | 0.08 | 0.7 | 3.0 |
3# | 6.0 | 0.09 | 0.1 | 2.0 | 11# | 4.0 | 0.03 | 0.4 | 4.0 |
4# | 8.0 | 0.01 | 0.5 | 4.5 | 12# | 6.0 | 0.06 | 0.8 | 3.5 |
5# | 10.0 | 0.04 | 0.9 | 1.5 | 13# | 8.0 | 0.08 | 0.3 | 3.0 |
6# | 12.0 | 0.07 | 0.2 | 4.0 | 14# | 12.0 | 0.02 | 0.7 | 2.0 |
7# | 14.0 | 0.1 | 0.6 | 1.0 | 15# | 14.0 | 0.04 | 0.2 | 1.5 |
8# | 16.0 | 0.02 | 1.0 | 3.5 | 16# | 16.0 | 0.07 | 0.6 | 1.0 |
Fig.1 Three-dimensional fluorescence spectra(A) and contour spectra(B) of MA, MDMA, COC and MOR mixtures, and the overlying contour spectra of four pure illegal drugs with urine(C)
Fig.3 Resolved and actual excitation spectra(A1—A3) and emission spectra(B1—B3) of 4 illegal drugs resolved by PARAFAC(A1, B1), SWATLD(A2, B2) and ATLD(A3, B3) with N=5
Drug | Algorithm | R | AR(%) | REP(%) | RMSEP/(mg·L-1) | SEN/(L·mg-1) | SEL | LOD/(mg·L-1) |
---|---|---|---|---|---|---|---|---|
MA | PARAFAC | 0.999 | 103.1 | 3.10 | 0.395 | 601 | 0.43 | 0.245 |
SWATLD | 0.999 | 101.0 | 1.85 | 0.275 | 575 | 0.41 | 0.356 | |
MDMA | PARAFAC | 0.999 | 95.7 | 4.63 | 0.002 | 7349 | 0.019 | 0.0003 |
SWATLD | 0.994 | 92.8 | 7.34 | 0.003 | 6969 | 0.018 | 0.0004 | |
COC | PARAFAC | 0.993 | 106.1 | 6.98 | 0.0358 | 1154 | 0.030 | 0.0339 |
SWATLD | 0.992 | 103.3 | 6.99 | 0.0352 | 1260 | 0.032 | 0.0410 | |
MOR | PARAFAC | 0.999 | 97.1 | 2.87 | 0.0666 | 373 | 0.028 | 0.0868 |
SWATLD | 0.998 | 100.6 | 3.37 | 0.0704 | 428 | 0.034 | 0.0125 |
Table 2 Figures of merit for determination of MA, MDMA, COC and MOR obtained from PARAFAC and SWATLD algorithms
Drug | Algorithm | R | AR(%) | REP(%) | RMSEP/(mg·L-1) | SEN/(L·mg-1) | SEL | LOD/(mg·L-1) |
---|---|---|---|---|---|---|---|---|
MA | PARAFAC | 0.999 | 103.1 | 3.10 | 0.395 | 601 | 0.43 | 0.245 |
SWATLD | 0.999 | 101.0 | 1.85 | 0.275 | 575 | 0.41 | 0.356 | |
MDMA | PARAFAC | 0.999 | 95.7 | 4.63 | 0.002 | 7349 | 0.019 | 0.0003 |
SWATLD | 0.994 | 92.8 | 7.34 | 0.003 | 6969 | 0.018 | 0.0004 | |
COC | PARAFAC | 0.993 | 106.1 | 6.98 | 0.0358 | 1154 | 0.030 | 0.0339 |
SWATLD | 0.992 | 103.3 | 6.99 | 0.0352 | 1260 | 0.032 | 0.0410 | |
MOR | PARAFAC | 0.999 | 97.1 | 2.87 | 0.0666 | 373 | 0.028 | 0.0868 |
SWATLD | 0.998 | 100.6 | 3.37 | 0.0704 | 428 | 0.034 | 0.0125 |
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