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Non-targeted screening (NTS) in mass spectrometry (MS) helps alleviate the shortcoming of targeted analysis such as missing the presence of concerning compounds that are not monitored and its lack of retrospective analysis to subsequently look for new contaminants. Most NTS workflows include high resolution tandem mass spectrometry (HRMS2) and structure annotation with libraries which are still limited. However, in silico combinatorial fragmentation tools that simulate MS2 spectra are available to help close the gap of missing compounds in empirical libraries. Three NTS tools were combined and used to detect and identify unknown contaminants at ultra-trace levels in surface waters in real samples in this qualitative study. Two of them were based on combinatorial fragmentation databases, MetFrag and the Similar Partition Searching algorithm (SPS), and the third, the Global Natural Products Social Networking (GNPS), was an ensemble of empirical databases. The three NTS tools were applied to the analysis of real samples from a local river. A total of 253 contaminants were identified by combining all three tools 209 were assigned a probable structure and 44 were confirmed using reference standards. The two major classes of contaminants observed were pharmaceuticals and consumer product additives. Among the confirmed compounds, octylphenol ethoxylates, denatonium, irbesartan and telmisartan are reported for the first time in surface waters in Canada. The workflow presented in this work uses three highly complementary NTS tools and it is a powerful approach to help identify and strategically select contaminants and their transformation products for subsequent targeted analysis and uncover new trends in surface water contamination.Exposure to colorless ammonia gas may lead to damage in human organs or even death. Herein, we describe facile fabrication of an environmentally-friendly, portable, reversible, and sensitive solid-state colorimetric cellulose (Cell)/anthocyanin (Anth) vapochromic sensor that exhibits instant visual color change to both gaseous and aqueous phases of ammonia. The naturally occurring anthocyanin can be easily extracted from the red-cabbage plant and applied as a direct dyestuff onto viscose fibers in the presence of potassium aluminum sulfate as mordant to generate nanoparticles of mordant/anthocyanin coordinated complex. Thus, upon exposure to aqueous ammonia, an instant color change of the smart (Cell-Anth) diagnostic assays, from purple to colorless, was noted and quantitatively probed via both CIE Lab coordinates and UV-Vis spectral measurements. Importantly, the fabricated (Cell-Anth) viscose fabric showed rapid responses, fraction of second, with a good limit of detection (LOD) in the range of 200-1200 mg L-1. This receptor also demonstrated ratiometric changes in the UV-Vis absorbance spectra, giving a hypsochromic shift from 611 to 375 nm upon increasing the total content of ammonia in an aqueous media. https://www.selleckchem.com/products/sis3.html The morphologies of Cell-Anth fabrics as well as particle size of the generated mordant/dye complex on the fabric surface have been characterized by transmission electron microscopic (TEM), scan electron microscopy (SEM), energy-dispersive X-ray patterns (EDX) and Fourier-transform infrared spectroscopic (FT-IR). The comfortability of the dyed cellulose fibers was also investigated in terms of their bend length, air-permeability and colorfastness properties. Significantly, the present study offers a promising onsite vapochromic device that enables detection of ammonia in either aqueous or gas phase in various environments and products.Isolation and enumeration of bacteria at ultralow concentrations and antibiotic resistance profiling are of great importance for early diagnosis and treatment of bacteremia. In this work, we describe a simple, rapid, and versatile magnetic-assisted microfluidic method for rapid bacterial detection. The developed method enables magnetophoretic loading of bead-captured bacteria into the microfluidic chamber under external static and dynamic magnetic fields in 4 min. A shallow microfluidic chamber design that enables the monolayer orientation and transportation of the beads and a glass substrate with a thickness of 0.17 mm was utilized to allow high-resolution fluorescence imaging for quantitative detection. Escherichia coli (E. coli) with green fluorescent protein (GFP)-expressing gene and streptavidin-modified superparamagnetic microbeads were used as model bacteria and capturing beads, respectively. The specificity of the method was validated using Lactobacillus gasseri as a negative control group. The limit of detection and limit of quantification values were determined as 2 CFU/ml and 10 CFU/ml of E. coli, respectively. The magnetic-assisted microfluidic method is a versatile tool for the detection of ultralow concentrations of viable bacteria with the linear range of 5-5000 CFU/ml E. coli in 1 h, and providing growth curves and phenotypic characterization bead-captured E. coli in the following 5 h of incubation. link2 Our results are promising for future rapid and sensitive antibiotic susceptibility testing of ultralow numbers of viable cells.In this article, a new air sampler based on a conventional computer fan is presented and evaluated. The fan has a double role as it acts as the air pumping system and supports the sorptive phases, which are located on its blades. The compact design and the reduced energy consumption (it can operate with a standard cell phone charger) confers high portability to the device. Also, a simple alternative integrated into the fan is proposed for using an internal standard during the sampling, thus increasing the precision of the measurements. In this first communication, sol-gel Carbowax 20 M coated fabric phases are used as sorptive membranes thanks to their planar geometry, mechanical and thermal stability, and their versatility covering different interaction chemistries. After sampling, the fabric phases are placed in a headspace vial, which is finally analyzed by gas chromatography-mass spectrometry. The sampler has been characterized for the extraction of selected volatile organic compounds (chloroform, benzaldehyde, toluene, and cyclohexane) from air and its versatility has also been evaluated by the identification of semi-volatile compounds in working place (toluene and xylene in laboratory residue storage room) and biogenic volatile compounds in natural samples (terpenes in fresh pine needles and orange peel samples).One of the critical challenges in the simultaneous determination of As3+ and Cu2+ by stripping voltammetry is the overlapping of their oxidation peaks. Therefore, the engineering of nanostructured sensors in order to uplift their electrochemical performance is a significant issue for the codetection of As3+ and Cu2+. link3 Herein, we modified a glassy carbon electrode with a new nanocomposite based on poly methyldopa along with gold nanoparticles immobilized on the surface of magnetic graphene oxide (GCE/GO/Fe3O4@PMDA/AuNPs) that can determine As3+ and Cu2+ with great sensitivity. Optimization of the measurement conditions by square wave stripping voltammetry (SWSV) caused the oxidation peaks of As3+ and Cu2+ to be distinguished significantly from each other, while the peak currents of As3+ and Cu2+ increased 9-12 fold, respectively, compared to the bare electrode. The proposed electrode exhibits low detection limits (S/N ≥ 3) 0.15 ppb for As3+ and 0.11 ppb for Cu2+. The GCE/GO/Fe3O4@PMDA/AuNPs also has good linearity over a wide concentration range from 5 to 500 ppb for As3+ and 0.5-750 ppb for Cu2+. The good recovery values were obtained for the analysis of As3+ and Cu2+ in pool and drinking water samples.Almost 13% of all death in the world is related to cancer. One of the major reasons for failing cancer treatment is the late diagnosis of the tumors. Thus, diagnosis at the early stages could be vital for the treatment. Serum autoantibodies, as tumor markers, are becoming interesting targets due to their medical and biological relevance. Among them, anti-p53 autoantibody in human sera is found to be involved in a variety of cancers. Regarding this issue, a novel and sensitive electrochemical biosensor for detection of anti-p53 autoantibody has been developed. For this purpose, a nanocomposite including thionine (as an electron transfer mediator)/chitosan/nickel hydroxide nanoparticles/electrochemically reduced graphene oxide (Th-CS-Ni(OH)2NPs-ERGO) as a support platform was fabricated on the surface of glassy carbon electrode via a layer-by-layer manner and characterized through common electrochemical and imaging techniques. Then, p53-antigen was immobilized on the nanocomposite and used in an indirect immunoassay with horseradish peroxidase (HRP)-conjugated secondary antibody and H2O2 as the substrate, following the typical Michaelis-Menten kinetics. Under optimized condition, two techniques, including differential Pulse Voltammetry (DPV) and Electrochemical Impedance Spectroscopy (EIS) as a label free technique, applied for the biomarker detection. The linear ranges and LODs were obtained 0.1-500 pg mL-1 and 0.001 pg mL-1 using DPV and 5-150 pg mL-1 and 0.007 pg mL-1 using EIS, respectively. Furthermore, the proposed biosensor displayed satisfying stability, selectivity, and reproducibility. According to the results, the presented protocol is promising to develop other electrochemical biosensors.In most cases, direct X-ray fluorescence (XRF) analysis of solutions entails technical difficulties due to a high X-ray scattering background resulting in a spectrum with a poor signal-to-noise ratio (SNR). Key factors that determine the sensitivity of the method are the energy resolution of the detector and the amount of scattered radiation in the energy range of interest. Limiting the width of the primary spectrum by the use of secondary targets, or filters, can greatly improve the sensitivity for specific portions of the spectrum. This paper demonstrates a potential method for SNR optimization in direct XRF analysis of chromium (Cr) contamination. The suggested method requires minimal sample preparation and achieves higher sensitivity compared to existing direct XRF analysis. Two states of samples, fly ash and leachate from municipal solid waste incineration, were investigated. The effects of filter material, its absorption edge and filter thickness were analyzed using the combination of Monte Carlo N-Particle (MCNP) code and energy-dispersive XRF spectrometry. The applied filter removes primary photons with energies interfering with fluorescence photons from the element of interest, thus results in lower background scattering in the spectrum. The SNR of Cr peak increases with filter thickness and reaches a saturation value when further increased thickness only increases the measurement time. Measurements and simulations show that a Cu filter with a thickness between 100 μm and 140 μm is optimal for detecting Cr by taking into account both the SNR and the exposure time. With direct XRF analysis for solutions, the limit of quantitation (LOQ) of the achieved system was 0.32 mg/L for Cr, which is well below the allowed standard limitation for landfills in Sweden. This work shows that XRF can gain enough sensitivity for direct monitoring to certify that the Cr content in leachate is below environmental limits.

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