• Spectroscopy and Spectral Analysis
  • Vol. 40, Issue 12, 3925 (2020)
Cui-mei LIU*, Yu HAN, Wei JIA, and Zhen-dong HUA
Author Affiliations
  • Key Laboratory of Drug Monitoring and Control, Drug Intelligence and Forensic Center, Ministry of Public Security, Beijing 100193, China
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    DOI: 10.3964/j.issn.1000-0593(2020)12-3925-05 Cite this Article
    Cui-mei LIU, Yu HAN, Wei JIA, Zhen-dong HUA. Rapid Qualitative Analysis of New Psychoactive Substances by Infrared Spectroscopy[J]. Spectroscopy and Spectral Analysis, 2020, 40(12): 3925 Copy Citation Text show less
    Structures and ATR-FTIR spectra of α-PiHP, α-PHP,Ethylone, and Dimethylone
    Fig. 1. Structures and ATR-FTIR spectra of α-PiHP, α-PHP,Ethylone, and Dimethylone
    Structures and ATR-FTIR spectra of 4-FA, 3-FA, and 2-FA
    Fig. 2. Structures and ATR-FTIR spectra of 4-FA, 3-FA, and 2-FA
    Structures and ATR-FTIR spectra of 2C-NBOMe serial compounds
    Fig. 3. Structures and ATR-FTIR spectra of 2C-NBOMe serial compounds
    Structures and ATR-FTIR spectra of α-PPP, α-POP, α-PHPP, α-PiHP, α-PHP, α-PVP, α-PBP, and α-PPP
    Fig. 4. Structures and ATR-FTIR spectra of α-PPP, α-POP, α-PHPP, α-PiHP, α-PHP, α-PVP, α-PBP, and α-PPP
    The histogram of the second matching coefficient value of 301 NPS compounds
    Fig. 5. The histogram of the second matching coefficient value of 301 NPS compounds
    Structures and ATR-FTIR spectra of α-PNP, α-PHPP, ADB-CHMINACA, AB-CHMINACA, 5F-ADB-PINACA, ADB-PINACA, 2C-T-7, and 2C-T-2
    Fig. 6. Structures and ATR-FTIR spectra of α-PNP, α-PHPP, ADB-CHMINACA, AB-CHMINACA, 5F-ADB-PINACA, ADB-PINACA, 2C-T-7, and 2C-T-2
    InstrumentSimilarity coefficient
    algorithm
    2C-T-2
    /2C-T-7
    ADB-PINACA
    /5F-ADB-PINACA
    α-PHPP
    /α-PNP
    AB-CHMINACA
    /ADB-CHMINACA
    PerkinElmer
    Frontier
    Correlation0.951.910.930.94
    Euclidean0.930.910.910.92
    SHIMADZU
    IRSpirit
    DiffDeriv0.900.890.860.93
    CorrDeriv0.940.950.900.96
    Difference 1. Deri0.770.750.690.79
    Correlation0.980.960.940.98
    SQ Difference Deri0.940.930.900.95
    Difference0.920.940.900.95
    SQ Difference0.990.990.981.00
    Euclidean0.900.900.870.93
    Table 1. Comparison of similarity coefficients by using different instruments and algorithms
    CompoundCharacteristic peaks/cm-1
    α-PNP1 688, 1 597, 1 448, 1 346, 1 224*, 925, 705, 683
    α-PHPP1 686, 1 448, 1 229*, 1 133*, 881*, 774*, 704, 682
    ADB-CHMINACA1 650, 1 526, 1 491, 1 397*, 1 175,
    1 132*, 825*, 748
    AB-CHMINACA1 648, 1 527, 1 491, 1 304, 1 226,
    1 175, 814*, 748
    5F-ADB-PINACA1 697, 1 648, 1 529, 1 489, 1 366,
    1 174*, 1 066*, 748
    ADB-PINACA1 695, 1 648, 1 529, 1 489, 1 365,
    1 181*, 825, 747
    2C-T-71 498, 1 464, 1 436, 1 237*, 1 206,
    1 038, 823*, 751*
    2C-T-21 490, 1 436, 1 256*, 1 206, 1 156,
    1 037, 850, 810
    Table 2. Characteristic peaks of structural analogues
    Cui-mei LIU, Yu HAN, Wei JIA, Zhen-dong HUA. Rapid Qualitative Analysis of New Psychoactive Substances by Infrared Spectroscopy[J]. Spectroscopy and Spectral Analysis, 2020, 40(12): 3925
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