Separation and identification of the synthetic cathinone isomers dipentylone and N-ethylpentylone using chromatographic and mass spectral characteristics

IF 2.6 3区 医学 Q2 CHEMISTRY, ANALYTICAL
Zehong Li , Yan Shi , Ziyi Li , Junbo Zhao , Xin Wang , Kuadou Wang , Mengxiang Su , Ping Xiang
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Abstract

Synthetic cathinone isomers exhibit very similar structure and physicochemical properties, which makes them unable to be effectively separated and identified, therefore increasing the likelihood of misidentification. In this study, the chromatographic and mass spectral characteristics of a sample by gas chromatography-mass spectrometry (GC–MS) were highly like those of N-ethylpentylone. The powder, however, was finally identified as dipentylone (also known as N, N-dimethylpentylone) by high performance liquid chromatography-linear ion trap-orbitrap mass spectrometry (HPLC-LTQ-Orbitrap-MS) and nuclear magnetic resonance (NMR). Because of the possibility of misidentification, the collision-induced dissociation (CID) and electron ionization (EI) pathways of dipentylone and its isomer N-ethylpentylone were further examined to assist forensic laboratories in identifying the synthetic cathinone isomers in their case work. The separation of the two isomers was successfully achieved through ultra-high performance liquid chromatography-mass spectrometry (UHPLC-MS/MS). These results demonstrate that the methods developed in this study can be used to separate and identify the two isomers.

Abstract Image

Abstract Image

利用色谱和质谱特征分离和鉴定合成卡西酮异构体二戊酮和 N-乙基戊酮
合成卡西酮异构体的结构和理化性质非常相似,因此无法对其进行有效分离和鉴别,从而增加了误认的可能性。在这项研究中,通过气相色谱-质谱法(GC-MS)对一个样品进行分析,其色谱和质谱特征与 N-乙基戊酮非常相似。但通过高效液相色谱-线性离子阱-轨道阱质谱(HPLC-LTQ-Orbitrap-MS)和核磁共振(NMR)分析,最终确定该粉末为二戊酮(又称 N,N-二甲基戊酮)。由于二戊酮及其异构体 N-ethylpentylone 有可能被误认,因此我们进一步研究了二戊酮及其异构体 N-ethylpentylone 的碰撞诱导解离(CID)和电子电离(EI)途径,以协助法医实验室在案件工作中识别合成卡西酮异构体。通过超高效液相色谱-质谱法(UHPLC-MS/MS)成功实现了两种异构体的分离。这些结果表明,本研究开发的方法可用于分离和鉴定这两种异构体。
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来源期刊
Forensic Chemistry
Forensic Chemistry CHEMISTRY, ANALYTICAL-
CiteScore
5.70
自引率
14.80%
发文量
65
审稿时长
46 days
期刊介绍: Forensic Chemistry publishes high quality manuscripts focusing on the theory, research and application of any chemical science to forensic analysis. The scope of the journal includes fundamental advancements that result in a better understanding of the evidentiary significance derived from the physical and chemical analysis of materials. The scope of Forensic Chemistry will also include the application and or development of any molecular and atomic spectrochemical technique, electrochemical techniques, sensors, surface characterization techniques, mass spectrometry, nuclear magnetic resonance, chemometrics and statistics, and separation sciences (e.g. chromatography) that provide insight into the forensic analysis of materials. Evidential topics of interest to the journal include, but are not limited to, fingerprint analysis, drug analysis, ignitable liquid residue analysis, explosives detection and analysis, the characterization and comparison of trace evidence (glass, fibers, paints and polymers, tapes, soils and other materials), ink and paper analysis, gunshot residue analysis, synthetic pathways for drugs, toxicology and the analysis and chemistry associated with the components of fingermarks. The journal is particularly interested in receiving manuscripts that report advances in the forensic interpretation of chemical evidence. Technology Readiness Level: When submitting an article to Forensic Chemistry, all authors will be asked to self-assign a Technology Readiness Level (TRL) to their article. The purpose of the TRL system is to help readers understand the level of maturity of an idea or method, to help track the evolution of readiness of a given technique or method, and to help filter published articles by the expected ease of implementation in an operation setting within a crime lab.
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