Coal origin traceability method based on infrared spectroscopy
A technology of infrared spectroscopy and origin traceability, which is applied in the direction of material analysis, measuring devices, and instruments through optical means, which can solve the problems of scattered origin traceability indicators and incomplete systems, and achieve high accuracy
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Embodiment 1
[0056] Example 1: Based on the provenance of coal Infrared spectroscopy
[0057] The present invention specifically provides a traceable origin of coal, the method established by the following method steps:
[0058] (1) coal samples taken from different areas of the sample collection specific information shown in Table 1. The samples were demineralized process.
[0059] TABLE 1 Coal Sample collection information table
[0060]
[0061]
[0062] (2) The sample was treated infrared spectra analysis;
[0063] (3) was subjected to infrared spectroscopy and OMNIC Origin curve fitting to obtain a peak;
[0064] (4) combined with previous studies to determine the functional group represented by the peaks, after principal component analysis and discriminant analysis to analyze the data obtained functional group, to establish the provenance model.
Embodiment 2
[0065] IR spectra acquired Embodiment 2 of Example
[0066] Demineralization step coal sample was:
[0067] 1) The coal sample into 15g 250ml glass beaker was charged with 3-5ml ethanol infiltration;
[0068] 2) The 5mol / L 80ml hydrochloric acid, poured into a beaker containing coal, and stirred in a water bath (60 ℃) heating IH;
[0069] 3) The sample is placed in a centrifuge tube, filled to 2 / 3, centrifuge 5min, the supernatant waste bottle was charged with distilled water as little as possible of the bottom of the sample, placed in a plastic beaker;
[0070] 4) were repeated in the heating and centrifugation with 80ml of 40% mass fraction of HF acid and concentrated hydrochloric acid;
[0071] 5) The tube containing the centrifuged bottom solids with distilled water to 2 / 3, shake, continued centrifugation, repeated 3-5 times, and PH test paper PH between 6 and 8;
[0072] 6) the solid-like air dried after centrifugation 6h, and then placed in a vacuum drying cabinet 16h.
[...
Embodiment 3
[0077] Example 3 acquires data according to a functional group
[0078] The resulting absorbance spectra using Origin for fitting spectra obtained spectrum peak, the spectrum of the previous studies to determine binding a functional group represented by the peak position, the Russian samples CD-2 as an example, the wave number (cm -1 ) At 3116.62023 Representative aromatic CH 2 chain; hydrogen bonding at 3257.61012 Representative alcohols; 3431.22411 representative of the association of the free hydroxyl group; 1 represents a phenol, an alcohol chain at 3552.94304 OH; 2852.67682 representative of the symmetric stretching vibration CH2; 2872.27979 representative of the symmetry RCH3 stretching; R3CH representative of stretching at 2899.01297; 2924.12971 representative of the asymmetrical stretching CH2; CH3 stretching vibration of the representative at 2972.88414; Representative alkanes at 1048.57978 methyl (CH3), rocking motion of the vibration; CH3 Representative chain at 1086.76...
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