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Analytical Chemistry

Working Paper

Cumulative Neutral Loss Model for Fragment Deconvolution in Electrospray Ionization High-Resolution Mass Spectrometry Data

Denice van Herwerden, Jake O'Brien, Sascha Lege, Bob Pirok, Kevin Thomas, Saer Samanipour

Version 1 posted 01 March 2023

157

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Analytical Chemistry

Working Paper

Natural complex mixtures unequivocally defined in formulae difference space

Anastasia Sarycheva, Irina V. Perminova, Eugene N. Nikolaev, Alexander Zherebker

Version 1 posted 08 July 2022

164

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Analytical Chemistry

Working Paper

Biological studies with comprehensive GCxGC-HRMS screening: Exploring the human sweat volatilome

Matyas Ripszam, Tobias Bruderer, Denise Biagini, Silvia Ghimenti, Tommaso Lomonaco, Fabio Di Francesco

Version 1 posted 05 October 2022

180

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Analytical Chemistry

Working Paper

Exploring the Chemical Subspace of RPLC: a Data Driven Approach

Denice van Herwerden, Alexandros Nikolopoulos, Leon Barron, Jake O'Brien, Bob Pirok, Kevin Thomas, Saer Samanipour

Version 3 posted 23 January 2024

561

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Earth, Space, and Environmental Chemistry

Working Paper

Machine Learning in Complex Organic Mixtures: Applying Domain Knowledge Allows for Meaningful Performance with Small Datasets.

Katelyn Le, Jagoš R. Radović, Justin L. MacCallum, Stephen R. Larter, Jeffrey F. Van Humbeck

Version 1 posted 18 April 2024

157

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Analytical Chemistry

Working Paper

Deciphering Isotopic Fine Structures of Silylated Compounds in Gas Chromatography - Vacuum Photoionization Orbitrap Mass Spectrometry of Bio-Oils

Silvia Juliana Vesga Martínez, Christopher Paul Rüger, Paul Kösling, Julian Schade, Sven Ehlert, Yury O. Tsybin, Ralf Zimmermann

Version 1 posted 20 September 2024

56

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Analytical Chemistry

Working Paper

Atmospheric Pressure Single Photon Laser Ionization (APSPLI) Mass Spectrometry Using a 157 Nm Fluorine Excimer Laser for Sensitive and Selective Detection of Non- to Semi-Polar Hydrocarbons

Christopher Rüger, Anika Neumann, Martin Sklorz, Ralf Zimmermann

Version 1 posted 11 November 2020

333

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Analytical Chemistry

Working Paper

Expanding the chemical coverage of polar compounds in water analysis by coupling supercritical fluid with hydrophilic interaction chromatography high-resolution mass spectrometry

Andrea Cerrato, Thomas Holmark, Erik Emke, Elvio D. Amato, Andrea F. G. Gargano

Version 1 posted 04 November 2024

100

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Analytical Chemistry

Working Paper

A comprehensive non-targeted analysis study of the prenatal exposome

Dimitri Abrahamsson, Aolin Wang, Ting Jiang, Miaomiao Wang, Aditya Siddharth, Rachel Morello-Frosch, June-Soo Park, Marina Sirota, Tracey J. Woodruff, Dimitri Panagopoulos Abrahamsson

Version 2 posted 13 May 2021

684

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Energy

Working Paper

Investigation of Island/ Single Core and Archipelago/ Multicore Enriched Asphaltenes and Their Solubility Fractions by Thermal Analysis Coupled to High Resolution Fourier Transform Ion Cyclotron Resonance Mass Spectrometry

Anika Neumann, Martha L. Chacón-Patiño, Ryan P. Rodgers, Christopher Rüger, Ralf Zimmermann

Version 1 posted 09 November 2020

564

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Refine Search

15 results in high-resolution mass spectrometry in Keywords: high-resolution mass spectrometry

Cumulative Neutral Loss Model for Fragment Deconvolution in Electrospray Ionization High-Resolution Mass Spectrometry Data

Natural complex mixtures unequivocally defined in formulae difference space

Biological studies with comprehensive GCxGC-HRMS screening: Exploring the human sweat volatilome

Exploring the Chemical Subspace of RPLC: a Data Driven Approach

Machine Learning in Complex Organic Mixtures: Applying Domain Knowledge Allows for Meaningful Performance with Small Datasets.

Deciphering Isotopic Fine Structures of Silylated Compounds in Gas Chromatography - Vacuum Photoionization Orbitrap Mass Spectrometry of Bio-Oils

Atmospheric Pressure Single Photon Laser Ionization (APSPLI) Mass Spectrometry Using a 157 Nm Fluorine Excimer Laser for Sensitive and Selective Detection of Non- to Semi-Polar Hydrocarbons

Expanding the chemical coverage of polar compounds in water analysis by coupling supercritical fluid with hydrophilic interaction chromatography high-resolution mass spectrometry

A comprehensive non-targeted analysis study of the prenatal exposome

Investigation of Island/ Single Core and Archipelago/ Multicore Enriched Asphaltenes and Their Solubility Fractions by Thermal Analysis Coupled to High Resolution Fourier Transform Ion Cyclotron Resonance Mass Spectrometry

15 results in Keywords: high-resolution mass spectrometry