High-Throughput Breath Volatile Organic Compound Analysis Using Thermal Desorption Proton Transfer Reaction Time-of-Flight Mass Spectrometry

Breath analysis is highly acceptable to patients and health care professionals, but its implementation in clinical practice remains challenging. Clinical trials and routine practice require a robust system for collection, storage, and processing of large numbers of samples. This work describes a pla...

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Bibliographic Details
Published in:Analytical chemistry (Washington) 2018-09, Vol.90 (17), p.10204-10210
Main Authors: Romano, Andrea, Doran, Sophie, Belluomo, Ilaria, Hanna, George Bushra
Format: Article
Language:English
Subjects:
Adenocarcinoma
Aldehydes
Aldehydes - analysis
Biomarkers
Breath Tests
Chemistry
Clinical trials
Coefficient of variation
Desorption
Fatty acids
Health care
Humans
Mass spectrometry
Mass Spectrometry - methods
Mass spectroscopy
Mathematical analysis
Medical research
Organic chemicals
Organic chemistry
Organic compounds
Phenols
Protons
Reaction time
Spectroscopy
Tubes
VOCs
Volatile organic compounds
Volatile Organic Compounds - analysis
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Summary:Breath analysis is highly acceptable to patients and health care professionals, but its implementation in clinical practice remains challenging. Clinical trials and routine practice require a robust system for collection, storage, and processing of large numbers of samples. This work describes a platform based upon the hyphenation of thermal desorption (TD) with proton transfer reaction time-of-flight mass spectrometry (PTR-ToF-MS), coupled by means of an original modification of the TD interface. The performance of TD-PTR-ToF-MS was tested against seven oxygenated volatile organic compounds (VOCs), belonging to three chemical classes (i.e., fatty acids, aldehydes, and phenols), previously identified as possible biomarkers of colorectal and esophago-gastric adenocarcinoma. Limits of detection and quantification were on the order of 0.2–0.9 and 0.3–1.5 parts per billion by volume (ppbV), respectively. Analytical recoveries from TD tubes were 80% or higher, linear response was in the low- to mid-ppbV range (R 2 = 0.98–0.99), and coefficients of variation were within 20% of mean values. The usability of the platform was evaluated in the analysis of a set of breath samples of clinical origin, allowing for a throughput of nearly 100 TD tubes for 24 h of continuous operation. All of these characteristics enhance the implementation of TD-PTR-ToF-MS for large-scale clinical studies.
ISSN:0003-2700
1520-6882
DOI:10.1021/acs.analchem.8b01045