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Mass Spectral Analysis of Chloropicrin under Negative ion Chemical ionization Conditions

机译:负离子化学电离条件下氯霉素的质谱分析

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A chemical ionization (CI) method is developed for the first time to obtain molecular weight information forchloropicrin (CP), which is used as a chemical warfare agent and as an insecticide. The study includes a detailedinvestigation on the behavior of CP under electron impact (EI) and CI. Reagent gases of different nature, i.e.,methane, isobutane, ammonia, hydrogen, and carbon dioxide, were used for CI analysis. Negative ion mode isfound more sensitive than positive ion mode for the EI/CI mass spectrometric analysis of CP, but none of themethods provided molecular weight information, except negative ion CI using ammonia as the reagent gas (NICI(NH_3)). The NICI (NH_3) showed formation of the quasimolecular ion, [M + H]~-, in addition to other adduct ions.The [M + H]~- abundance critically depends on the source t6mperature, reagent gas pressure, and concentration ofthe analyte, and it can be 13percent under optimized conditions by which CP can be confirmed unambiguously. Thismethod meets the criteria used in official proficiency tests conducted by OPCW for confirming the molecular weightof the unknowns.
机译:首次开发了化学电离(CI)方法,以获得氯仿(CP)的分子量信息,其用作化学战剂和杀虫剂。该研究包括对CP在电子冲击(EI)和CI下的行为的详细研究。不同性质的反应气(即甲烷,异丁烷,氨,氢和二氧化碳)用于CI分析。对于CP的EI / CI质谱分析,发现负离子模式比正离子模式更敏感,但是除了使用氨作为反应气的负离子CI(NICI(NH_3))之外,没有一种方法提供分子量信息。 NICI(NH_3)除其他加成离子外,还显示了准分子离子[M + H]〜-的形成。[M + H]〜-的丰度主要取决于离子源的温度,反应气压力和浓度分析物,并且在优化条件下可以达到13%,从而可以明确确定CP。该方法符合禁化武组织进行的官方能力验证所用的标准,以确认未知分子的分子量。

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