法医学杂志

法医学杂志 ›› 2024, Vol. 40 ›› Issue (6): 550-556.DOI: 10.12116/j.issn.1004-5619.2024.340103

所属专题： 高分辨质谱技术专题

• 高分辨质谱技术专题 • 上一篇    下一篇

新型合成卡西酮类物质CMMP的检验

何思阳1(), 邓乾亚1, 郑水庆1,2, 倪春芳1,2, 孙文娟1, 曹芳琦3, 梁晨1,2, 龚飞君1,2()   

  1. 1.上海市公安局物证鉴定中心 上海市现场物证重点实验室，上海 200083
    2.上海公安学院，上海 200137
    3.上海市刑事科学技术研究院，上海 　200072
  • 收稿日期:2024-01-17 发布日期:2025-03-10 出版日期:2024-12-25
  • 通讯作者: 龚飞君
  • 作者简介:何思阳（1988—），男，副高级工程师，主要从事毒品与毒物的检验研究；E-mail：xhesy@foxmail.com
  • 基金资助:
    公安部科技计划项目(2023YY12);上海市2021年度“科技创新行动计划”社会发展科技攻关定向项目(21dz1200301);上海市公安局科学技术发展基金资助项目(2022012)

Identification of a Novel Synthetic Cathinone CMMP

Si-yang HE1(), Qian-ya DENG1, Shui-qing ZHENG1,2, Chun-fang NI1,2, Wen-juan SUN1, Fang-qi CAO3, Chen LIANG1,2, Fei-jun GONG1,2()   

  1. 1.Shanghai Key Laboratory of Crime Scene Evidence, Institute of Forensic Science, Shanghai Public Security Bureau, Shanghai 200083, China
    2.Shanghai Police College, Shanghai 200137, China
    3.Shanghai Research Institute of Criminal Science and Technology, Shanghai 200072
  • Received:2024-01-17 Online:2025-03-10 Published:2024-12-25
  • Contact: Fei-jun GONG

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摘要：

目的 建立基于气相色谱-四极杆飞行时间质谱（gas chromatography-quadrupole time-of-flight mass spectrometry，GC-QTOF-MS）、超高效液相色谱-四极杆/静电场轨道阱高分辨质谱（ultra-high performance liquid chromatography-quadrupole/electrostatic field orbitrap high resolution mass spectrometry，UPLC-Q/Orbitrap HRMS）和核磁共振（nuclear magnetic resonance，NMR）技术联合鉴定未知样品的方法。 方法 未知样品用甲醇溶解后供GC-QTOF-MS和UPLC-Q/Orbitrap HRMS检测，用氘代甲醇溶解后供NMR检测。 结果 未知物在GC-QTOF-MS中保留时间为9.67 min的组分实测主要特征离子峰有84.080 8、110.999 7、128.107 0（基峰）和138.994 7等，UPLC-Q/Orbitrap HRMS中实测质子化分子离子m/z为268.109 3。对比合成卡西酮类物质2-甲基-1-（4-甲硫基苯基）-2-吗啉基丙-1-酮［2-methyl-1-[4-（methylthio）phenyl]-2-morpholinopropan-1-one，MTMP］的质谱信息和分子结构，推测未知物为MTMP的类似物。经NMR分析确认为新型N-吗啉取代的合成卡西酮类物质，即1-（4-氯苯基）-2-甲基-2-吗啉基丙-1-酮［1-（4-chlorophenyl）-2-methyl-2-morpholinopropan-1-one，CMMP］。 结论 本研究建立的方法可用于CMMP的结构确证。

关键词: 法医学, 毒物分析, 新精神活性物质, 合成卡西酮类, 2-甲基-1-（4-甲硫基苯基）-2-吗啉基丙-1-酮（MTMP）, 1-（4-氯苯基）-2-甲基-2-吗啉基丙-1-酮（CMMP）, 高分辨质谱, N-吗啉取代

Abstract:

Objective To establish a method to identify an unknown substance based on the combined use of gas chromatography-quadrupole time-of-flight mass spectrometry （GC-QTOF-MS）, ultra-high performance liquid chromatography-quadrupole/electrostatic field orbitrap high resolution mass spectrometry （UPLC-Q/Orbitrap HRMS）and nuclear magnetic resonance （NMR） techniques. Methods The unknown substance was dissolved in methanol and was detected by GC-QTOF-MS and UPLC-Q/Orbitrap HRMS, and was dissolved in methanol-d4 to be detected by NMR. Results The main characteristics ion peaks of components with retention time of 9.67 min in GC-QTOF-MS measured were 84.080 8, 110.999 7, 128.107 0 （base peak）, 138.994 7, etc. The protonated molecular ion peak m/z in UPLC-Q/Orbitrap HRMS was 268.109 3. It was inferred that the unknown substance was an analog of the synthetic cathinone substance 2-methyl-1-[4-（methylthio）phenyl]-2-morpholinopropan-1-one （MTMP） by comparing the mass spectrum information and molecular structure of MTMP. NMR analysis confirmed it as a novel N-morpholine substituted synthetic cathinone substance 1-（4-chlorophenyl）-2-methyl-2-morpholinopropan-1-one （CMMP）. Conclusion The method established in this study can be used for structural confirmation of CMMP.

Key words: forensic medicine, toxicological analysis, new psychoactive substance （NPS）, synthetic cathinones, 2-methyl-1-[4-（methylthio）phenyl]-2-morpholinopropan-1-one （MTMP）, 1-（4-chlorophenyl）-2-methyl-2-morpholinopropan-1-one （CMMP）, high resolution mass spectrometry （HRMS）, N-morpholine substituted

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