Active compound | Spectrum region for analysis [cm−1] | Statistical method | Calibration model | Validation model | |||
r2 | SEC | r2 | SEP | ||||
Carvacrol | 1125 - 1095 | PLS | 0.982 | 0.961 | 0.987 | 0.923 | |
|
| PLS-1st derivative | 0.993 | 0.672 | 0.996 | 0.620 | |
Thymol | 1170 - 1140 | PLS | 0.978 | 0.920 | 0.981 | 0.948 | |
|
| PLS-1st derivative | 0.994 | 0.695 | 0.995 | 0.636 | |
P-cymene | 1050 - 1017 | PLS | 0.988 | 0.904 | 0.975 | 0.910 | |
|
| PLS-1st derivative | 0.992 | 0.823 | 0.993 | 0.785 | |