交钥匙解决方案
Lowest false positive rate
Getting it right first time
Analyzing complex food/water samples for drugs, pesticides or mycotoxins, or equally challenging human/animal urine, saliva, or serum samples for poisons or drugs, is a demanding application. TargetScreener HR is a powerful solution based upon accurate mass analysis with Bruker QTOF systems and highly curated databases (over 2800 compounds) to ensure reporting false positives (or false negatives) is minimized. Obtaining highly accurate quantitative data is also assured with TargetScreener HR.
Added to the powerful mass spectrometer system are TargetScreener HR integrated software algorithms, methods, columns and databases to allow it to work ‘out of the box’.
Proven to minimize false positives
使用所有信息消除虚假正面和假阴性识别以实现明确的识别的重要性不能过分压力。
Reliance on precursor accurate mass and retention time alone can lead to a high number of false positive/negative results.
Mass spectra also contains very informative isotope patterns and characteristic fragmentation patterns and by utilizing the full data content available, false positives and false negatives are essentially eliminated.
可以通过使用宽带CID(BBCID)数据采集扫描模式来获得这种广泛的数据集,以在整个实验过程中连续生成高分辨率准确的质量父离子,真实的同位素模式强度和碎片预选赛。将所有这些数据结合在一起并添加保留时间信息与TargetScreener HR意味着实际上消除了假阳性检测,从而对您的筛查结果产生了最大的信心。
During the screening process, the QTOF mass spectrometer rapidly and continuously cycles between low collision energy (TOF-MS) and elevated collision energy (bbCID) MS/MS, resulting in the seamless collection of accurate mass precursor and fragment ion data in a single analysis.
At the heart of the TargetScreener solution is the exact mass pesticide database. In addition to high resolution monoisotopic precursor ion masses and retention time data, the database also contains up to ten high resolution diagnostic qualifier ion information, comprising of accurate mass bbCID fragments and 'in source' fragment ions as well as adduct and isomer information.
Intelligent Data Review utilizing ‘exception based’ algorithms
数据处理对screening and quantitation is powered by TASQ® (Target Analysis for Screening and Quantitation) software. TASQ® intelligently uses the diagnostic qualifier ions to reduce false positive detections, bringing a new level of confidence to screening workflows.
为了完全对结果的信心,在目标屏幕仪HR工作流程中使用了四个确认的维度:
Color coded screening results are easily reviewed in either a sample centric or analyte centric fashion as desired by the analyst. Once reviewed, qualitative and quantitative sample reports are then easily generated.
TargetScreener detects 'all of the ions, all of the time' in full scan MS and MS/MS modes without compromising sensitivity or resolution which results in a dataset that is complete and unrestricted. The diagnostic qualifier ions can then be used as a part of an enhanced confirmation criterion to eliminate false positive findings as well as delivering unambiguous ID's for co-eluting isobaric drugs.
Key reasons for implementing TargetScreener HR
Using TargetScreener HR means that within the analytical run time of 20 minutes the system collects ‘all of the data, all of the time’ thus providing retrospective and unknown identification capabilities. Hence, if previously run samples are required to be screened for new compounds of interest then a simple operation allows this without the need to reinject the sample.
The highly curated large database provides the highest chance of eliminating false positive and false negative rates by using resolution, accurate mass, isotopic patterns, adducts and bbCID fragmentation patterns and comparing to the acquired data. The system is also highly sensitive and quantitative for use in food safety or drugs of abuse work and required legal limits of detection.
TargetScreener HR非常强大,可深入,调查性筛查和定量以及回顾性数据挖掘。
版本4.0在目标屏幕仪HR解决方案中添加了几个关键功能:
分析复杂的体液的存在drugs and/or toxicants together with their associated metabolites is a challenging application especially when ‘getting it right first time’ is of major importance. TargetScreener HR is designed to meet these challenges and either accurately report which drugs/toxicants are present in the sample, or if no matches are found in the database, then provide several key pieces of analytical data and information to give the best chance of elucidating an identification.
TargetScreener人力资源 - 获取完整视图
TargetScreener HR is designed specifically for use with Bruker QTOF mass spectrometers to enable comprehensive targeted forensic screening and clinical screening, confirmation and quantitation of drugs and other toxicants in human body fluids. The solution is highly automated and hence minimizes method development time for toxicological screening.
的核心TargetScreener人力资源是一个high-quality forensic database of over 2,000 compounds of forensic relevance. The high resolution (HR) database includes exact mass data for parent ions, adducts, fragment ions as well as isotopic pattern and retention time information delivering maximum confidence in the end result and with a total injection to injection analysis time of 20 minutes.
为了增加灵活性,用户可以轻松地在HR-MS数据库中添加新化合物,从而使未来几年的投资未来,并提供对先前分析的样本进行回顾性分析的能力。
针对新的精神活性物质(NP)
The ability to add new compounds to the HR-MS database using a standardized protocol is particularly pertinent given the explosion in the number of new synthetic cannabinoids hitting the drug scene. Given that TargetScreener HR collects ‘all of the data, all of the time’, all data files contain all the information required to retrospectively re-screen a previously analyzed sample when new compounds have been added to the database.
Should a positive ID still not be achieved, the mass spectra of an unknown peak will contain pseudo molecular ion accurate mass information, true isotopic ion (TIP – registered trade mark) for elemental composition and accurate mass fragment ions thus allowing the best chance of elucidating a chemical structure.
Furthermore, significant advances within Bruker’s QTOF instruments have resulted in systems which are both very sensitive and possess a large linear dynamic range in their response thus making them eminently suitable for quantitative studies.
Collectively, these benefits make TargetScreener HR the most powerful tool for in-depth forensic analysis.
自动化工作流程超过MRL
Analyzing for food contaminants to levels which meet regulatory maximum residue limits (MRLs) in a wide variety of complex matrices is a challenge which TargetScreener HR excels at. Food and water analysis often present similar challenges, where compound classes such as pesticides and hormones are frequently encountered. The power within TargetScreener HR handles such challenges with ease.
Pesticide analysis and food contaminants screening
使用农药来减少农作物的损害并提高园艺生产率已在全球范围内实施了多年,并且由于其毒性,这些化学物质的潜在迁移到人类食品和供水链中引起了相当大的健康问题。因此,MRL允许食物中的农药。饲料和水由地方和国际监管机构严格控制。
TargetScreener HR is specifically designed to deal with these challenges by ensuring that during data acquisition, all compounds eluting from the UPLC column have molecular ion data and fragmentation spectra acquired all of the time. Hence no compound is missed. This is achieved by rapidly cycling between different scan modes to ensure a seamless collection of precursor and fragment ion data in a single dataset.
这样的数据集包含伪分子离子,加合离子,碎片离子和同位素模式以及它们的保留时间。数据库使用了所有这些信息,以提供增强的复合识别水平,因此大大最大程度地减少了假阳性结果的假阳性的可能性。单独的前体精确质量和保留时间的测量可能会导致大量的假阳性结果,尤其是在诸如Quechers提取的复杂矩阵的情况下。
All detected compounds can then be quantified against their MRL and reports generated with a high level of confidence.
Using TargetScreener HR allows over在水和食物分析中精确筛选和量化的2000种化合物准确地报告了确保存在污染物的存在。
“每当我们的实验室需要进行更深入的分析时,目标屏幕仪是我们的首选解决方案。提供全面扫描和BBCID高分辨率大量信息,也允许进行完全回顾性的数据评估,它非常适合交易案件。with ‘general unknown screening’. It is a valuable tool for identifying new psychoactive substances (NPS) and their metabolites, assisting with their structural elucidation and analytical characterization. The TargetScreener also proved to be very useful for comprehensive drug screening in alternative matrices, especially hair samples ."
For Research Use Only. Not for use in clinical diagnostic procedures.