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Mass defect filter technique and its applications to drug metabolite identification by high‐resolution mass spectrometry

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What this work says

Outgoing claims: the papers this work cites, builds on, or argues with.

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Bioactivation of the tricyclic antidepressant amitriptyline and its metabolite nortriptyline to arene oxide intermediates in human liver microsomes and recombinant P450s

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Recent advances in applications of liquid chromatography–tandem mass spectrometry to the analysis of reactive drug metabolites

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Incoming claims: where this work appears in other papers’ reference lists and arguments.

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inferred← citeshttps://doi.org/10.1007/978-3-031-07392-2_16openalex-snapshot

Metabolomics Profiling of Di-(2-propylheptyl) Phthalate (DPHP) Biotransformation Products as Exposure Markers: Analytical Strategy and Application

inferred← citeshttps://doi.org/10.1007/978-3-319-19276-5_4openalex-snapshot

Non-target UHPLC/MS Analysis of Emerging Contaminants in Water

inferred← citeshttps://doi.org/10.1007/978-981-33-6064-8_20openalex-snapshot

The Application of Mass Spectrometry in Drug Metabolism and Pharmacokinetics

inferred← citeshttps://doi.org/10.1007/978-981-95-8423-9_7openalex-snapshot

Pharmacokinetic and Safety Profiles of Phytoecdysteroids in Mammals

inferred← citeshttps://doi.org/10.1007/s00204-022-03224-2openalex-snapshot

Developments in high-resolution mass spectrometric analyses of new psychoactive substances

inferred← citeshttps://doi.org/10.1007/s00216-011-5641-8openalex-snapshot

High-resolution mass spectrometry for integrated qualitative and quantitative analysis of pharmaceuticals in biological matrices

inferred← citeshttps://doi.org/10.1007/s00216-013-7132-6openalex-snapshot

Identification of urinary metabolites of imperatorin with a single run on an LC/Triple TOF system based on multiple mass defect filter data acquisition and multiple data mining techniques

inferred← citeshttps://doi.org/10.1007/s00216-021-03189-8openalex-snapshot

Applications of stable isotopes in MALDI imaging: current approaches and an eye on the future

inferred← citeshttps://doi.org/10.1007/s00216-021-03201-1openalex-snapshot

A strategy combining solid-phase extraction, multiple mass defect filtering and molecular networking for rapid structural classification and annotation of natural products: characterization of chemical diversity in Citrus aurantium as a case study

inferred← citeshttps://doi.org/10.1007/s00216-022-04347-2openalex-snapshot

Generic approach for the discovery of drug metabolites in horses based on data-dependent acquisition by liquid chromatography high-resolution mass spectrometry and its applications to pharmacokinetic study of daprodustat

inferred← citeshttps://doi.org/10.1007/s00280-024-04744-7openalex-snapshot

Pharmacokinetics, mass balance, and metabolism of [14C]PLB1004, a selective and irreversible EGFR-TKI in humans

inferred← citeshttps://doi.org/10.1007/s00280-025-04779-4openalex-snapshot

Pharmacokinetics, mass balance, and metabolism of [14C]FCN-437c, a selective and potent CDK4/6 inhibitor in humans

inferred← citeshttps://doi.org/10.1007/s11306-014-0713-3openalex-snapshot

Integration of untargeted metabolomics with transcriptomics reveals active metabolic pathways

inferred← citeshttps://doi.org/10.1007/s11306-015-0882-8openalex-snapshot

High resolution mass spectrometry for structural identification of metabolites in metabolomics

inferred← citeshttps://doi.org/10.1007/s11306-016-1064-zopenalex-snapshot

Urinary antihypertensive drug metabolite screening using molecular networking coupled to high-resolution mass spectrometry fragmentation

inferred← citeshttps://doi.org/10.1007/s11356-014-3187-yopenalex-snapshot

Post-acquisition data processing for the screening of transformation products of different organic contaminants. Two-year monitoring of river water using LC-ESI-QTOF-MS and GCxGC-EI-TOF-MS

inferred← citeshttps://doi.org/10.1007/s11356-018-1484-6openalex-snapshot

Exposure marker discovery of di(isononyl)cyclohexane-1,2-dicarboxylate using two mass spectrometry-based metabolite profiling data processing methods

inferred← citeshttps://doi.org/10.1007/s13361-015-1269-9openalex-snapshot

High Resolution Mass Spectrometry of Polyfluorinated Polyether-Based Formulation

inferred← citeshttps://doi.org/10.1007/s13361-017-1741-9openalex-snapshot

Mass Defect from Nuclear Physics to Mass Spectral Analysis

inferred← citeshttps://doi.org/10.1007/s13361-018-2069-9openalex-snapshot

Computational Removal of Undesired Mass Spectral Features Possessing Repeat Units via a Kendrick Mass Filter

inferred← citeshttps://doi.org/10.1016/b978-0-12-397922-3.00005-8openalex-snapshot

Potential of Fourier Transform Mass Spectrometry for High-Throughput Metabolomics Analysis

inferred← citeshttps://doi.org/10.1016/b978-0-12-409547-2.12364-9openalex-snapshot

Role of ADME/PK in Drug Discovery, Safety Assessment, and Clinical Development

inferred← citeshttps://doi.org/10.1016/b978-0-12-809464-8.00002-6openalex-snapshot

HRMS

inferred← citeshttps://doi.org/10.1016/b978-0-12-820018-6.00003-xopenalex-snapshot

High-resolution mass spectrometry-based data acquisition and data-mining technologies for detecting and characterizing drug metabolites and traditional Chinese medicine components

inferred← citeshttps://doi.org/10.1016/b978-0-12-820018-6.00014-4openalex-snapshot

Metabolites in safety testing (MIST)

inferred← citeshttps://doi.org/10.1016/b978-0-323-90560-2.00010-8openalex-snapshot

Profiling the reactive metabolites of xenobiotics in cancer

inferred← citeshttps://doi.org/10.1016/b978-0-323-95488-4.00161-3openalex-snapshot

Analytical Methods in Biotransformation Studies

inferred← citeshttps://doi.org/10.1016/b978-0-444-53810-9.00001-8openalex-snapshot

High Mass Resolution Versus MS/MS

inferred← citeshttps://doi.org/10.1016/bs.acc.2020.02.009openalex-snapshot

Mass spectrometry-based metabolomics for an in-depth questioning of human health

inferred← citeshttps://doi.org/10.1016/bs.coac.2016.01.004openalex-snapshot

High-Resolution Mass Spectrometry in Metabolite Identification

inferred← citeshttps://doi.org/10.1016/bs.coac.2016.02.011openalex-snapshot

Suspect Screening of Pharmaceuticals and Related Bioactive Compounds, Their Metabolites and Their Transformation Products in the Aquatic Environment, Biota and Humans Using LC-HR-MS Techniques

inferred← citeshttps://doi.org/10.1016/bs.coac.2024.10.009openalex-snapshot

Liquid chromatography-mass spectrometry for comprehensive research of new psychoactive substances

inferred← citeshttps://doi.org/10.1016/j.aca.2010.05.020openalex-snapshot

Comprehensive comparison of liquid chromatography selectivity as provided by two types of liquid chromatography detectors (high resolution mass spectrometry and tandem mass spectrometry): “Where is the crossover point?”

inferred← citeshttps://doi.org/10.1016/j.aca.2013.01.012openalex-snapshot

A new strategy for the discovery of epimedium metabolites using high-performance liquid chromatography with high resolution mass spectrometry

inferred← citeshttps://doi.org/10.1016/j.aca.2013.04.012openalex-snapshot

An integrated strategy for in vivo metabolite profiling using high-resolution mass spectrometry based data processing techniques

inferred← citeshttps://doi.org/10.1016/j.aca.2016.07.032openalex-snapshot

Urinary exposure marker discovery for toxicants using ultra-high pressure liquid chromatography coupled with Orbitrap high resolution mass spectrometry and three untargeted metabolomics approaches

inferred← citeshttps://doi.org/10.1016/j.aca.2018.10.062openalex-snapshot

Structure/reaction directed analysis for LC-MS based untargeted analysis

inferred← citeshttps://doi.org/10.1016/j.aca.2018.11.009openalex-snapshot

Profiling and comparison of toxicant metabolites in hair and urine using a mass spectrometry-based metabolomic data processing method

inferred← citeshttps://doi.org/10.1016/j.aca.2021.338270openalex-snapshot

Determination of drugs and drug metabolites by ion mobility-mass spectrometry: A review

inferred← citeshttps://doi.org/10.1016/j.aca.2022.339814openalex-snapshot

Mass defect filter technique combined with stable isotope tracing for drug metabolite identification using high-resolution mass spectrometry

inferred← citeshttps://doi.org/10.1016/j.aca.2025.344615openalex-snapshot

Modified two-dose difference with stable isotope tracing workflow using mass shift defect filtering substantially reduces false positives in untargeted nifedipine metabolite profiling

inferred← citeshttps://doi.org/10.1016/j.aca.2025.344751openalex-snapshot

An untargeted data mining strategy for extracting chemical exposome signatures from LC-HRMS data: Application to meconium for early-life exposure assessment

inferred← citeshttps://doi.org/10.1016/j.apsb.2012.02.010openalex-snapshot

LC–MS-based metabolomics in profiling of drug metabolism and bioactivation

inferred← citeshttps://doi.org/10.1016/j.apsb.2021.02.017openalex-snapshot

Insight into chemical basis of traditional Chinese medicine based on the state-of-the-art techniques of liquid chromatography−mass spectrometry

inferred← citeshttps://doi.org/10.1016/j.bcp.2010.06.002openalex-snapshot

Comparative metabolism of cyclophosphamide and ifosfamide in the mouse using UPLC–ESI-QTOFMS-based metabolomics

inferred← citeshttps://doi.org/10.1016/j.chemosphere.2017.10.162openalex-snapshot

Identification of urinary biomarkers of exposure to di-(2-propylheptyl) phthalate using high-resolution mass spectrometry and two data-screening approaches

inferred← citeshttps://doi.org/10.1016/j.chemosphere.2022.137443openalex-snapshot

Critical assessment of the Kendrick mass defect analysis as an innovative approach to process high resolution mass spectrometry data for environmental applications

inferred← citeshttps://doi.org/10.1016/j.chroma.2012.01.017openalex-snapshot

Rapid identification of ophiopogonins and ophiopogonones in Ophiopogon japonicus extract with a practical technique of mass defect filtering based on high resolution mass spectrometry

inferred← citeshttps://doi.org/10.1016/j.chroma.2014.10.091openalex-snapshot

Current approaches and challenges for the metabolite profiling of complex natural extracts

inferred← citeshttps://doi.org/10.1016/j.chroma.2016.03.080openalex-snapshot

Identification of flurochloridone metabolites in rat urine using liquid chromatography/high resolution mass spectrometry

inferred← citeshttps://doi.org/10.1016/j.chroma.2017.06.015openalex-snapshot

Chemicalome and metabolome profiling of polymethoxylated flavonoids in Citri Reticulatae Pericarpium based on an integrated strategy combining background subtraction and modified mass defect filter in a Microsoft Excel Platform

inferred← citeshttps://doi.org/10.1016/j.chroma.2017.10.043openalex-snapshot

Data acquisition workflows in liquid chromatography coupled to high resolution mass spectrometry-based metabolomics: Where do we stand?

inferred← citeshttps://doi.org/10.1016/j.chroma.2018.03.044openalex-snapshot

Integrated strategy for identifying minor components in complex samples combining mass defect, diagnostic ions and neutral loss information based on ultra-performance liquid chromatography-high resolution mass spectrometry platform: Folium Artemisiae Argyi as a case study

inferred← citeshttps://doi.org/10.1016/j.chroma.2018.05.067openalex-snapshot

A two-step ultra-high-performance liquid chromatography-quadrupole/time of flight mass spectrometry with mass defect filtering method for rapid identification of analogues from known components of different chemical structure types in Fructus Gardeniae-Fructus Forsythiae herb pair extract and in…

inferred← citeshttps://doi.org/10.1016/j.chroma.2021.461903openalex-snapshot

An integrated analytical approach based on enhanced fragment ions interrogation and modified Kendrick mass defect filter data mining for in-depth chemical profiling of glucosinolates by ultra-high-pressure liquid chromatography coupled with Orbitrap high resolution mass spectrometry

inferred← citeshttps://doi.org/10.1016/j.chroma.2021.462650openalex-snapshot

Ultra-high pressure liquid chromatography coupled to travelling wave ion mobility-time of flight mass spectrometry for the screening of pharmaceutical metabolites in wastewater samples: Application to antiretrovirals

inferred← citeshttps://doi.org/10.1016/j.chroma.2022.463145openalex-snapshot

A database-guided integrated strategy for comprehensive chemical profiling of traditional Chinese medicine

inferred← citeshttps://doi.org/10.1016/j.ddtec.2012.10.015openalex-snapshot

High-throughput, computer assisted, specific MetID. A revolution for drug discovery

inferred← citeshttps://doi.org/10.1016/j.ddtec.2021.10.004openalex-snapshot

Mass spectrometry based approaches and strategies in bioanalysis for qualitative and quantitative analysis of pharmaceutically relevant molecules

inferred← citeshttps://doi.org/10.1016/j.dmd.2025.100131openalex-snapshot

Pharmacokinetics, mass balance, and metabolism of [14C]SAF-189s, a potent anaplastic lymphoma kinase/c-ROS proto-oncogene 1 inhibitor in humans: Metabolism potentially affected by interaction of cytochrome P450 enzymes and intestinal microbiota

inferred← citeshttps://doi.org/10.1016/j.drudis.2015.07.011openalex-snapshot

Exploration of individuality in drug metabolism by high-throughput metabolomics: The fast line for personalized medicine

inferred← citeshttps://doi.org/10.1016/j.ecoenv.2024.117236openalex-snapshot

Advanced metabolomics-based approach to reveal new insights into Bisphenol A metabolism and its presence in human excreta and water bodies in Taiwan

inferred← citeshttps://doi.org/10.1016/j.ejps.2017.04.014openalex-snapshot

Novel sulphur-containing imatinib metabolites found by untargeted LC-HRMS analysis

inferred← citeshttps://doi.org/10.1016/j.envint.2016.11.026openalex-snapshot

Trends in the application of high-resolution mass spectrometry for human biomonitoring: An analytical primer to studying the environmental chemical space of the human exposome

inferred← citeshttps://doi.org/10.1016/j.envint.2024.109134openalex-snapshot

Metabolite identification of emerging disinfection byproduct dibromo-benzoquinone in vivo and in vitro: Multi-strategy mass-spectrometry annotation and toxicity characterization

inferred← citeshttps://doi.org/10.1016/j.fitote.2017.10.005openalex-snapshot

Identification of berberrubine metabolites in rats by using ultra-high performance liquid chromatography coupled with quadrupole time-of-flight mass spectrometry

inferred← citeshttps://doi.org/10.1016/j.foodchem.2014.09.025openalex-snapshot

Metabolic study of enrofloxacin and metabolic profile modifications in broiler chicken tissues after drug administration

inferred← citeshttps://doi.org/10.1016/j.foodchem.2023.136400openalex-snapshot

Rapid screening and characterization of 2-(2-phenylethyl)chromones in agarwood by UHPLC-Q-Exactive Orbitrap-MS

inferred← citeshttps://doi.org/10.1016/j.foodchem.2025.145060openalex-snapshot

Comprehensive identification and discovery of novel sterol compounds in Cordyceps sinensis and related species

inferred← citeshttps://doi.org/10.1016/j.ijms.2022.116992openalex-snapshot

Analysis of unknown fentanyl analogs using high resolution mass spectrometry with mass defect filtering

inferred← citeshttps://doi.org/10.1016/j.jas.2021.105468openalex-snapshot

Droplet probe: A non-destructive residue analysis of Wari ceramics from the imperial heartland

inferred← citeshttps://doi.org/10.1016/j.jbiotec.2016.09.005openalex-snapshot

Aptamer-based trapping of phytosphingosine in urine samples

inferred← citeshttps://doi.org/10.1016/j.jchromb.2010.02.013openalex-snapshot

A review of LC–MS techniques and high-throughput approaches used to investigate drug metabolism by cytochrome P450s

inferred← citeshttps://doi.org/10.1016/j.jchromb.2010.10.029openalex-snapshot

Evidence of the formation of direct covalent adducts of primaquine, 2-tert-butylprimaquine (NP-96) and monohydroxy metabolite of NP-96 with glutathione and N-acetylcysteine

inferred← citeshttps://doi.org/10.1016/j.jchromb.2011.04.015openalex-snapshot

Structural identification of the metabolites for strictosamide in rats bile by an ion trap-TOF mass spectrometer and mass defect filter technique

inferred← citeshttps://doi.org/10.1016/j.jchromb.2011.08.025openalex-snapshot

Full-scan high resolution accurate mass spectrometry (HRMS) in regulated bioanalysis: LC–HRMS for the quantitation of prednisone and prednisolone in human plasma

inferred← citeshttps://doi.org/10.1016/j.jchromb.2017.09.015openalex-snapshot

Systematic characterization of the metabolites of paeonol in rats using ultra performance liquid chromatography coupled with electrospray ionization quadrupole time-of-flight tandem mass spectrometry with an integrative strategy

inferred← citeshttps://doi.org/10.1016/j.jchromb.2018.05.044openalex-snapshot

A targeted strategy to identify untargeted metabolites from in vitro to in vivo: Rapid and sensitive metabolites profiling of licorice in rats using ultra-high performance liquid chromatography coupled with triple quadrupole-linear ion trap mass spectrometry

inferred← citeshttps://doi.org/10.1016/j.jchromb.2019.121843openalex-snapshot

Capsaicin metabolites and GSH-associated detoxification and biotransformation pathways in human liver microsomes revealed by LC-HRMS/MS with data-mining tools

inferred← citeshttps://doi.org/10.1016/j.jchromb.2025.124695openalex-snapshot

Simulation of sildenafil metabolism using an electrochemical oxidation system

inferred← citeshttps://doi.org/10.1016/j.jchromb.2026.125302openalex-snapshot

Development and validation of an LC-MS/MS method for the novel PROTAC KT-474 in rat and mouse plasma: Application to dose-dependent pharmacokinetics and metabolite identification in mice

inferred← citeshttps://doi.org/10.1016/j.jclinepi.2021.02.008openalex-snapshot

Metabolomics data complemented drug use information in epidemiological databases: pilot study of potential kidney donors

inferred← citeshttps://doi.org/10.1016/j.jep.2020.112719openalex-snapshot

Analysis of the similarities and differences between Auclandia and Vladimirae rhizomes by chemical profiling and chemometric analysis

inferred← citeshttps://doi.org/10.1016/j.jfda.2018.11.002openalex-snapshot

Exposure marker discovery of di-2(propylheptyl) phthalate using ultra-performance liquid chromatography-mass spectrometry and a rat model

inferred← citeshttps://doi.org/10.1016/j.jpba.2010.05.004openalex-snapshot

Rapid and global detection and characterization of aconitum alkaloids in Yin Chen Si Ni Tang, a traditional Chinese medical formula, by ultra performance liquid chromatography–high resolution mass spectrometry and automated data analysis

inferred← citeshttps://doi.org/10.1016/j.jpba.2014.01.014openalex-snapshot

High-resolution mass spectrometry applied to the identification of transformation products of quinolones from stability studies and new metabolites of enrofloxacin in chicken muscle tissues

inferred← citeshttps://doi.org/10.1016/j.jpba.2015.01.043openalex-snapshot

Metabolic profile of miltirone in rats by high performance liquid chromatography/quadrupole time-of-flight mass spectrometry

inferred← citeshttps://doi.org/10.1016/j.jpba.2015.02.028openalex-snapshot

An integrated high resolution mass spectrometric data acquisition method for rapid screening of saponins in Panax notoginseng (Sanqi)

inferred← citeshttps://doi.org/10.1016/j.jpba.2015.03.026openalex-snapshot

Identification of metabolites of PSORALEAE FRUCTUS in rats by ultra performance liquid chromatography coupled with quadrupole time-of-flight tandem mass spectrometry analysis

inferred← citeshttps://doi.org/10.1016/j.jpba.2015.11.029openalex-snapshot

Cell-based assays in combination with ultra-high performance liquid chromatography-quadrupole time of flight tandem mass spectrometry for screening bioactive capilliposide C metabolites generated by rat intestinal microflora

inferred← citeshttps://doi.org/10.1016/j.jpba.2016.06.047openalex-snapshot

Metabolic profile of 5-hydroxy-4-methoxycanthin-6-one, a typical canthinone alkaloid, in rats determined by liquid chromatography-quadrupole time-of-flight tandem mass spectrometry together with multiple data processing techniques

inferred← citeshttps://doi.org/10.1016/j.jpba.2019.03.040openalex-snapshot

Pharmacokinetics and metabolism of GW9508 in rat by liquid chromatography/electrospray ionization tandem mass spectrometry

inferred← citeshttps://doi.org/10.1016/j.jpba.2019.04.045openalex-snapshot

Pharmacokinetics and metabolism of H3B-6545, a selective estrogen receptor covalent antagonist, in dog plasma by liquid chromatography combined with electrospray ionization tandem mass spectrometry

inferred← citeshttps://doi.org/10.1016/j.jpba.2019.05.049openalex-snapshot

An integrated strategy based on characteristic fragment filter supplemented by multivariate statistical analysis in multi-stage mass spectrometry chromatograms for the large-scale detection and identification of natural plant-derived components in rat: The rhubarb case

inferred← citeshttps://doi.org/10.1016/j.jpba.2021.114312openalex-snapshot

Recent advances in identifying and utilizing metabolites of selected doping agents in human sports drug testing

inferred← citeshttps://doi.org/10.1016/j.jpba.2022.114679openalex-snapshot

Rapid screening and identification of metabolites of murpanicin in rats by UHPLC/Q-TOF-MS/MS combined with diagnostic fragment ions (DFIs) and multiple mass defect filter

inferred← citeshttps://doi.org/10.1016/j.jpba.2023.115400openalex-snapshot

A mass defect filtering combined background subtraction strategy for rapid screening and identification of metabolites in rat plasma after oral administration of Yindan Xinnaotong soft capsule

inferred← citeshttps://doi.org/10.1016/j.jpba.2023.115842openalex-snapshot

Rapid and comprehensive metabolites identification of 5-demethylnobiletin in rats using UPLC/Triple-TOF-MS/MS based on multiple mass defect filter and their neuroprotection against ferroptosis

inferred← citeshttps://doi.org/10.1016/j.jpba.2023.115958openalex-snapshot

Integrated post-acquisition data processing strategy for rapid steroid sulfate characterization in Toad gall-bladder

inferred← citeshttps://doi.org/10.1016/j.jpba.2025.117007openalex-snapshot

Two advanced metabolomics-based data processing approaches for comprehensive drug metabolite identification using high-resolution mass spectrometry

inferred← citeshttps://doi.org/10.1016/j.jpba.2025.117269openalex-snapshot

Characterization of In Vitro metabolic profiles of crepidatin in human liver microsomes and hepatocytes using HPLC-MS/MS and HPLC-Q-Orbitrap-HRMS

inferred← citeshttps://doi.org/10.1016/j.jpha.2021.02.003openalex-snapshot

An integrated strategy for comprehensive characterization of metabolites and metabolic profiles of bufadienolides from Venenum Bufonis in rats

inferred← citeshttps://doi.org/10.1016/j.jprot.2012.07.048openalex-snapshot

WITHDRAWN: Simple-statistical and composite-statistical scrutinizers to optimize metabolome coverage

inferred← citeshttps://doi.org/10.1016/j.microc.2024.112287openalex-snapshot

Strategy of mass defect filter combined with characteristic fragment analysis for the chemical profiling of Dictamnus dasycarpus Turcz. From multiple regions

inferred← citeshttps://doi.org/10.1016/j.phymed.2022.154261openalex-snapshot

Global analysis of qualitative and quantitative metabolism of Notoginsenoside R1 in rat liver-brain-gut axis based on LC-IT-TOF/MS combing mMDF strategy

inferred← citeshttps://doi.org/10.1016/j.scitotenv.2013.12.057openalex-snapshot

Using biomarkers in wastewater to monitor community drug use: A conceptual approach for dealing with new psychoactive substances

inferred← citeshttps://doi.org/10.1016/j.scitotenv.2017.01.063openalex-snapshot

Metabolic profiling identification of metabolites formed in Mediterranean mussels ( Mytilus galloprovincialis ) after diclofenac exposure

inferred← citeshttps://doi.org/10.1016/j.talanta.2024.126921openalex-snapshot

An integrated 3-M workflow for accelerated annotation of natural products: Flavonoids in Daemonorops draco as a case study

inferred← citeshttps://doi.org/10.1016/j.talanta.2024.127209openalex-snapshot

Utilizing two-dose difference combined with stable isotope tracing for effective and comprehensive metabolite identification of pioglitazone via ultra-high-performance liquid chromatography–mass spectrometry

inferred← citeshttps://doi.org/10.1016/j.talanta.2025.129116openalex-snapshot

A comprehensive characterization strategy for natural products using dual-mode hybrid acquisition on high-resolution MS with intelligent subdivision polygonal mass defect filtering: a case study on Typhae Pollen

inferred← citeshttps://doi.org/10.1016/j.talanta.2026.129582openalex-snapshot

A systematically optimized two-dose differential strategy integrating stable isotope tracing and mass shift defect filtering for reducing false positives in high-resolution mass spectrometry–based drug metabolite profiling

inferred← citeshttps://doi.org/10.1016/j.tox.2013.08.010openalex-snapshot

Analytical challenges for conducting rapid metabolism characterization for QIVIVE

inferred← citeshttps://doi.org/10.1016/j.trac.2010.10.014openalex-snapshot

Metabolite identification by liquid chromatography-mass spectrometry

inferred← citeshttps://doi.org/10.1016/j.trac.2015.04.021openalex-snapshot

Quadrupole time-of-flight mass spectrometry as a powerful tool for demystifying traditional Chinese medicine

inferred← citeshttps://doi.org/10.1016/j.trac.2016.02.009openalex-snapshot

From targeted quantification to untargeted metabolomics: Why LC-high-resolution-MS will become a key instrument in clinical labs

inferred← citeshttps://doi.org/10.1016/j.trac.2016.09.005openalex-snapshot

How to really perform high throughput metabolomic analyses efficiently?

inferred← citeshttps://doi.org/10.1016/j.trac.2021.116188openalex-snapshot

Data processing strategies for non-targeted analysis of foods using liquid chromatography/high-resolution mass spectrometry

inferred← citeshttps://doi.org/10.1016/j.trac.2021.116409openalex-snapshot

Recent advances in data-mining techniques for measuring transformation products by high-resolution mass spectrometry

inferred← citeshttps://doi.org/10.1016/j.watres.2016.07.056openalex-snapshot

Comparing targeted and non-targeted high-resolution mass spectrometric approaches for assessing advanced oxidation reactor performance

inferred← citeshttps://doi.org/10.1016/s1674-6384(15)60055-7openalex-snapshot

Identification of Icaritin Metabolites in Rats by LC-MS/MS

inferred← citeshttps://doi.org/10.1021/ac100287aopenalex-snapshot

Pooled Sample Strategy in Conjunction with High-Resolution Liquid Chromatography−Mass Spectrometry-Based Background Subtraction to Identify Toxicological Markers in Dogs Treated with Ibipinabant

inferred← citeshttps://doi.org/10.1021/ac200349gopenalex-snapshot

Analytical Strategies for Assessment of Human Metabolites in Preclinical Safety Testing

inferred← citeshttps://doi.org/10.1021/ac202034kopenalex-snapshot

Identification of Di-isononyl Phthalate Metabolites for Exposure Marker Discovery Using In Vitro/In Vivo Metabolism and Signal Mining Strategy with LC-MS Data

inferred← citeshttps://doi.org/10.1021/ac504767dopenalex-snapshot

High-Resolution Twin-Ion Metabolite Extraction (HiTIME) Mass Spectrometry: Nontargeted Detection of Unknown Drug Metabolites by Isotope Labeling, Liquid Chromatography Mass Spectrometry, and Automated High-Performance Computing

inferred← citeshttps://doi.org/10.1021/acs.analchem.0c00652openalex-snapshot

Metabolite Identification of Therapeutic Peptides and Proteins by Top-down Differential Mass Spectrometry and Metabolite Database Matching

inferred← citeshttps://doi.org/10.1021/acs.analchem.1c00972openalex-snapshot

Improving the Screening Analysis of Pesticide Metabolites in Human Biomonitoring by Combining High-Throughput In Vitro Incubation and Automated LC–HRMS Data Processing

inferred← citeshttps://doi.org/10.1021/acs.analchem.1c04925openalex-snapshot

Tandem Mass Spectrometry Molecular Networking as a Powerful and Efficient Tool for Drug Metabolism Studies

inferred← citeshttps://doi.org/10.1021/acs.analchem.3c02419openalex-snapshot

Identification of Xenobiotic Biotransformation Products Using Mass Spectrometry-Based Metabolomics Integrated with a Structural Elucidation Strategy by Assembling Fragment Signatures

inferred← citeshttps://doi.org/10.1021/acs.analchem.5b01205openalex-snapshot

Targeted Data-Independent Acquisition and Mining Strategy for Trace Drug Metabolite Identification Using Liquid Chromatography Coupled with Tandem Mass Spectrometry

inferred← citeshttps://doi.org/10.1021/acs.analchem.5b03790openalex-snapshot

Enhanced Mass Defect Filtering To Simplify and Classify Complex Mixtures of Lignin Degradation Products

inferred← citeshttps://doi.org/10.1021/acs.analchem.6b01214openalex-snapshot

xMSannotator: An R Package for Network-Based Annotation of High-Resolution Metabolomics Data

inferred← citeshttps://doi.org/10.1021/acs.analchem.6b03902openalex-snapshot

Dynamic Cluster Analysis: An Unbiased Method for Identifying A + 2 Element Containing Compounds in Liquid Chromatographic High-Resolution Time-of-Flight Mass Spectrometric Data

inferred← citeshttps://doi.org/10.1021/acs.analchem.8b01388openalex-snapshot

Highly Accurate Detection and Identification Methodology of Xenobiotic Metabolites Using Stable Isotope Labeling, Data Mining Techniques, and Time-Dependent Profiling Based on LC/HRMS/MS

inferred← citeshttps://doi.org/10.1021/acs.chemrestox.3c00209openalex-snapshot

Discovery of Modified Metabolites, Secondary Metabolites, and Xenobiotics by Structure-Oriented LC–MS/MS

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