Cristina Youngren , Harri Kiljunen , Harri A. Heikkinen , Rahim Ullah , Susanne K. Wiedmer , Paula Vanninen
{"title":"诺维乔克A-234在不同去污剂中的水解产物表征及水解速率测定","authors":"Cristina Youngren , Harri Kiljunen , Harri A. Heikkinen , Rahim Ullah , Susanne K. Wiedmer , Paula Vanninen","doi":"10.1016/j.jcoa.2025.100210","DOIUrl":null,"url":null,"abstract":"<div><div>In this work, studies on the neutralization of Novichok A-234, a member of a class of nerve agents known for their high toxicity, were carried out. Three decontaminants of different composition were used; these were alkaline potassium hydroxide in ethanol, GDS-2000, and Biodecon-83, a deep eutectic solvent. After 24 and 120 h of exposure to each decontaminant, the degradation products were characterized by ultra-high performance liquid chromatography-mass spectrometry (UPLC-MS) and UPLC-tandem MS. The rate of hydrolysis of Novichok A-234 in each decontaminant was measured using <sup>31</sup>P nuclear magnetic resonance (NMR) spectroscopy. The three decontaminants showed large variations in the hydrolysis rates of Novichok A-234. The total required decontamination time until Novichok A-234 was no longer observed by <sup>31</sup>P NMR, ranged from 5 to 44 h. <em>In silico</em> calculations were performed to predict the toxicity of the main decontamination products. All hydrolysis compounds were of lower toxicity than Novichok A-234.</div></div>","PeriodicalId":93576,"journal":{"name":"Journal of chromatography open","volume":"7 ","pages":"Article 100210"},"PeriodicalIF":3.2000,"publicationDate":"2025-03-02","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":"{\"title\":\"Characterization of hydrolysis products and determination of the rate of hydrolysis of Novichok A-234 in different decontaminants\",\"authors\":\"Cristina Youngren , Harri Kiljunen , Harri A. Heikkinen , Rahim Ullah , Susanne K. Wiedmer , Paula Vanninen\",\"doi\":\"10.1016/j.jcoa.2025.100210\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"<div><div>In this work, studies on the neutralization of Novichok A-234, a member of a class of nerve agents known for their high toxicity, were carried out. Three decontaminants of different composition were used; these were alkaline potassium hydroxide in ethanol, GDS-2000, and Biodecon-83, a deep eutectic solvent. After 24 and 120 h of exposure to each decontaminant, the degradation products were characterized by ultra-high performance liquid chromatography-mass spectrometry (UPLC-MS) and UPLC-tandem MS. The rate of hydrolysis of Novichok A-234 in each decontaminant was measured using <sup>31</sup>P nuclear magnetic resonance (NMR) spectroscopy. The three decontaminants showed large variations in the hydrolysis rates of Novichok A-234. The total required decontamination time until Novichok A-234 was no longer observed by <sup>31</sup>P NMR, ranged from 5 to 44 h. <em>In silico</em> calculations were performed to predict the toxicity of the main decontamination products. All hydrolysis compounds were of lower toxicity than Novichok A-234.</div></div>\",\"PeriodicalId\":93576,\"journal\":{\"name\":\"Journal of chromatography open\",\"volume\":\"7 \",\"pages\":\"Article 100210\"},\"PeriodicalIF\":3.2000,\"publicationDate\":\"2025-03-02\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"\",\"citationCount\":\"0\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"Journal of chromatography open\",\"FirstCategoryId\":\"1085\",\"ListUrlMain\":\"https://www.sciencedirect.com/science/article/pii/S2772391725000088\",\"RegionNum\":0,\"RegionCategory\":null,\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"\",\"JCRName\":\"\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"Journal of chromatography open","FirstCategoryId":"1085","ListUrlMain":"https://www.sciencedirect.com/science/article/pii/S2772391725000088","RegionNum":0,"RegionCategory":null,"ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"","JCRName":"","Score":null,"Total":0}
Characterization of hydrolysis products and determination of the rate of hydrolysis of Novichok A-234 in different decontaminants
In this work, studies on the neutralization of Novichok A-234, a member of a class of nerve agents known for their high toxicity, were carried out. Three decontaminants of different composition were used; these were alkaline potassium hydroxide in ethanol, GDS-2000, and Biodecon-83, a deep eutectic solvent. After 24 and 120 h of exposure to each decontaminant, the degradation products were characterized by ultra-high performance liquid chromatography-mass spectrometry (UPLC-MS) and UPLC-tandem MS. The rate of hydrolysis of Novichok A-234 in each decontaminant was measured using 31P nuclear magnetic resonance (NMR) spectroscopy. The three decontaminants showed large variations in the hydrolysis rates of Novichok A-234. The total required decontamination time until Novichok A-234 was no longer observed by 31P NMR, ranged from 5 to 44 h. In silico calculations were performed to predict the toxicity of the main decontamination products. All hydrolysis compounds were of lower toxicity than Novichok A-234.