Semivolatile Organic Compounds In Water Research Articles

Rapid green analytical methodology for simultaneous monitoring of nitrosamines and semi-volatile organic compounds in water and human urine samples.

Nitrosamines and semi-volatile organic compounds (SVOCs) are carcinogenic contaminants in water and biological matrices. Conventional analytical methods often struggle to detect trace concentrations due to poor extraction efficacies. This study presents a novel, low-cost, in-syringe-assisted fast extraction cum cleanup technique coupled with GC-FID for monitoring four nitrosamines and two SVOCs in drinking water and human urine samples to measure the contamination and exposure levels. This extraction protocol combines a novel green in-syringe liquid-liquid extraction step using dimethyl carbonate as the green extraction solvent, coupled with a semi-automated solid-phase extraction cleanup process. Then, the final extractant is analyzed using gas chromatography-flame ionization detection (GC-FID) for monitoring. The method demonstrated excellent linearity (R2 > 0.998) between 1.5 and 500ngmL⁻1 for all six target compounds. Detection limits ranged from 1.0 to 2.0ngmL⁻1. Extraction recoveries were between 87 and 105% for both urine samples and water samples. Intra-day and inter-day precision were below 9% RSD. The blue applicability grade index evaluation scored 70.0, indicating good practical applicability. The developed analytical protocol offers a sensitive, accurate, low-cost, rapid, and environmentally friendly method for simultaneously quantifying multiple nitrosamines and SVOCs in environmental and human samples. Its performance characteristics and sustainability metrics suggest the potential for broad application in monitoring and exposure studies.

Modelling studies of the diffusivity and intersolubility of semi volatile organic compounds in water

Semi-volatile organic compounds (SVOCs) are hazardous contaminants found in several products - ranging from personal care products to plastic products and the environment. Their chemical migration into food substances, raising environmental and health concerns, has been well documented. The dispersion/diffusion and solubility of SVOCs in food simulants is an indicator of their migration from food packaging materials. Here, we employed molecular dynamics simulations to investigate molecular mass transfer/diffusivity and intersolubility of three (S)VOCs from various sources into water. The simulation results illustrated that the molecular weight of SVOCs affects their dispersion and solubility in water. SVOC molecules are also much easier to diffuse into water at higher temperatures and longer time periods. The intersolubility of SVOCs in water according to the Flory-Huggins parameter (χ) and Hildebrand solubility parameter (δ) occurs in the following order: methyl isocyanate > caprolactam > naphthalene. The solubility of SVOCs increases with temperature, as evident by the decreasing δSVOCs and χsvocs. These results will play a key role in expanding the knowledge base of chemical migration of small molecules into food simulants.

Simultaneous determination of 46 semi-volatile organic compounds in water by liquid-liquid extraction-gas chromatography-mass spectrometry

半挥发性有机物主要包括多环芳烃类(PAHs)、邻苯二甲酸酯类(PAEs)、有机氯农药类(OCPs)和硝基苯类(NBs)等化合物,这些物质多具有致癌、致畸、致突变作用,以及内分泌干扰效应。因此,快速准确测定水中半挥发性有机物非常重要,目前国内尚无水中半挥发性有机物的检测标准。该研究从氮吹温度、水样pH值和萃取时间3个方面进行了优化,旨在建立一种液液萃取-气相色谱-质谱(LLE-GC-MS)同时测定水中46种半挥发性有机物的方法。结果表明:氮吹温度对46种半挥发性有机物的回收率影响不大,考虑回收率及浓缩效率,将氮吹温度设定为35 ℃;水样在中性环境下萃取效果好于碱性环境下的效果;萃取时间由7 min增加至10 min时,回收率也随之提高,但时间增加至15 min时,17种(占比37%)化合物回收率有所增加,29种(占比63%)化合物回收率则呈降低趋势。因此,将萃取时间设定为每次10 min。采用气相色谱-质谱仪进行检测,内标法定量。该方法在20.0~2000 μg/L范围内线性良好,相关系数(r 2)≥0.9916, 46种SVOCs检出限为0.28~16.55 ng/L,定量限为0.92~55.16 ng/L;在0.02、0.2、0.4 μg/L 3个加标水平下的平均回收率为63.6%~125%,相对标准偏差(n=6)为1.03%~17.0%。采用该方法检测了黄河流域济南段的27个地表水样品,检出的物质以PAEs和PAHs为主,2种OCPs在部分点位有检出,NBs均未检出。该方法操作简单,通用性强,准确度及精密度良好,检出限低,适用于地表水及地下水中46种半挥发性有机物的同时检测。

Determination of OCPs, OPPs, and 21 SVOCs in water and sediment samples in five rivers of Shenzhen, China, during the period of 2017 and 2018.

One hundred two semivolatile organic compounds (SVOCs), including 20 organochlorine pesticides (OCPs) and 12 organophosphorus pesticides (OPPs), were determined in the main rivers of Shenzhen, China. As a result, p,p'-dichlorodiphenyldichloroethane (DDD), aldrin, and benzoepin sulfate were the main OCPs detected in surface water, and p,p'-DDD, heptachlor, and endrin aldehyde were the main compounds in sediment. In addition, diazinon was the most frequent OPP detected in both water and sediment. At most sites, SVOCs were at similar concentration levels in 2017 and 2018. Compared with other areas, diazinon and malathion had comparative high concentrations in Maozhou River in this study. Analyzed from the SVOCs concentrations in water and sediment, p,p'-DDD was from the quick degradation of p,p'-dichlorodiphenyltrichloroethane (DDT), and no recent DDT was input around the investigated area. Besides, the interrelationships among these pollutants were calculated, revealing that OPPs were mainly from the chronically cumulative content, rather than the directly transferring from surface water to sediment. According to the risk assessment, the occurrence of p,p'-DDD and p,p'-DDT affected the aquatic community. All in all, further investigations on the occurrence and source of these pollutants are still needed to avoid the potential risk for human beings living around the contaminated environment.

Development of a magnetic solid-phase extraction coupled with gas chromatography and mass spectrometry method for the analysis of semivolatile organic compounds.

Semivolatile organic compounds are a category of organic micropollutants including phthalate esters, polycyclic aromatic hydrocarbons and so on, which are commonly analyzed by solid-phase extraction followed by gas chromatography with mass spectrometry. In this work, a highly sensitive and feasible method of magnetic solid-phase extraction combined with gas chromatography with mass spectrometry was established for the determination of semivolatile organic compounds in water. The novel method was based on a permanent magnetic resin with uniform particle size and high surface area (1154.3 m2 /g). The results demonstrated that the extraction efficiency of the resin was superior to that of a C18 cartridge. The method was proved to be of satisfactory recoveries (75-115.7%) and limits of detection and quantification (0.063-6.524 and 0.212-21.745 μg/L, respectively). The method was applied to the analysis of semivolatile organic compounds in the midstream Huai River. It was observed that polychlorinated biphenyls exceeded current water standards. To further illustrate the potential effects on human health, health risk assessment was conducted based on the obtained data. The existence of health risk was proved, with hexachlorobenzene and 2,2',4,4'-tetrachlorobiphenyl as the major causes. The method possesses the characteristics of high efficiency and rapid analysis, offering a good prospect of applications in large quantities of practical water.

지표수에서 GC/MS에 의한 25개 준휘발성유기화합물의 극미량 분석

A gas chromatography-mass spectrometric (GC-MS) method was developed for determining 25 semivolatile organic compounds in water. A 1.0 L water sample was placed in a separatory funnel and saturated with NaCl, and the solution was extracted two times with 40 mL of methylene chloride. Under the established condition, the linear quantification range was 0.02-800 ng/L and the relative standard deviation was less than 15%. The method was used to analyze 16 surface water samples collected from various regions in Gum-River. The samples revealed SVOC concentrations in the range of 0.02-96.8 ng/L. Maximum concentrations of VOCs detected were not exceeded the EPA or Germany guidelines in any of the samples. The developed method may be valuable for monitoring SVOCs in water.

Determination of selected semi-volatile organic compounds in water using automated online solid-phase extraction with large-volume injection/gas chromatography/mass spectrometry

A rapid, sensitive, and cost-effective analytical method was developed for the analysis of selected semi-volatile organic compounds in water. The method used an automated online solid-phase extraction technique coupled with programmed-temperature vaporization large-volume injection gas chromatography/mass spectrometry. The water samples were extracted by using a fully automated mobile rack system based on x-y-z robotic techniques using syringes and disposable 96-well extraction plates. The method was validated for the analysis of 30 semivolatile analytes in drinking water, groundwater, and surface water. For a sample volume of 10 mL, the linear calibrations ranged from 0.01 or 0.05 to 2.5 μg·L−1, and the method detection limits were less than 0.1 μg·L−1. For the reagent water samples fortified at 1.0 μg·L−1 and 2.0 μg·L−1, the obtained mean absolute recoveries were 70%–130% with relative standard deviations of less than 20% for most analytes. For the drinking water, groundwater, and surface water samples fortified at 1.0 μg·L−1, the obtained mean absolute recoveries were 50%–130% with relative standard deviations of less than 20% for most analytes. The new method demonstrated three advantages: 1) no manipulation except the fortification of surrogate standards prior to extraction; 2) significant cost reduction associated with sample collection, shipping, storage, and preparation; and 3) reduced exposure to hazardous solvents and other chemicals. As a result, this new automated method can be used as an effective approach for screening and/or compliance monitoring of selected semi-volatile organic compounds in water.

Online in situ analysis of selected semi-volatile organic compounds in water by automated microscale solid-phase extraction with large-volume injection/gas chromatography/mass spectrometry

A fully automated analytical method was developed for the online in situ analysis of selected semi-volatile organic compounds in water. The method used a large-volume injection/gas chromatography/mass spectrometry coupled with a fully automated microscale solid-phase extraction technique, which was based on x– y– z robotic techniques. Water samples were extracted by using a 96-well solid-phase extraction plate. For most analytes included in this study, the obtained linear calibrations ranged from 0.05 to 5.0 μg/L with correlation coefficients of 0.996–1.000, the method detection limits were less than 0.1 μg/L, and the relative recoveries were in the range of 70–120% with a relative standard deviation of less than 15% for fortified reagent water samples. The applications to chlorinated tap water, well water, and river water have been validated. The obtained results were similar to those resulting from fortified reagent water samples for all analytes except metribuzin, bromacil, aldrin, and methoxychlor. Matrix effects were observed for these analytes. In general, this fully automated analytical method was rugged, reliable, and easy to operate, and was capable of providing real-time data to water treatment and distribution systems as well as water reservation and protection systems. In addition, the method could reduce the analytical costs associated with sample collection, transportation, storage, and preparation.

Capillary microextraction for simultaneous analysis of multi-residual semivolatile organic compounds in water

Capillary microextractor (CME) in combination with a gas chromatograph-mass spectrometer (GC-MS) was employed for the determination of trace priority hazardous substances in water. Three groups of semivolatile organic compounds (SVOCs), i.e., chlorinated hydrocarbons, pesticides and polycyclic aromatic hydrocarbons (PAHs), were simultaneously determined. SVOCs were extracted from 7 mL of water samples on a 100 cm commercial gas chromatographic column (0.32 mm id x film thickness 0.25 microm, HP-5 capillary column) and eluted with only 3 microL of acetonitrile. The extractant was analyzed by GC-MS in the selected ion monitoring mode. The method showed good linearity over the concentration range 10 ng L(-1) to 3.0 mg L(-1) with correlation coefficients (r) greater than 0.99 and low limits of detection ranged from 10 ng L(-1) to 1.0 mg L(-1). High recovery (more than 80%) was obtained with relative standard deviation less than 10%. The method was successfully applied for trace level analyses of SVOCs in water samples.

Solid-phase enrichment, thermal desorption, and ion mobility spectrometry for field screening of organic pollutants in water

Semivolatile organic compounds in water can be determined by using field-compatible methods through extraction with alkyl-bonded membranes, vaporization by thermal desorption, and characterization by ion mobility spectrometry (IMS). Water containing phthalate esters at 1-50 ppm was extracted for 1 h as an unstirred solution by direct contact with thin strips of C8-bonded membranes. Vapors released from the strips at 200 o C were analyzed with a hand-held ion mobility spectrometer (IMS)