TY - JOUR
T1 - Implementing the Use of Collision Cross Section Database for Phycotoxin Screening Analysis
AU - Aparicio-Muriana, Maria Mar
AU - Bruni, Renato
AU - Lara, Francisco J.
AU - del Olmo-Iruela, Monsalud
AU - Hernandez-Mesa, Maykel
AU - García-Campaña, Ana M.
AU - Dall’Asta, Chiara
AU - Righetti, Laura
PY - 2023/7/5
Y1 - 2023/7/5
N2 - The increased consumption of blue-green algae (BGA)-based dietary supplements has raised concern about their food safety, especially about cyanotoxin presence. The hyphenation of liquid chromatography with ion mobility mass spectrometry represents a relevant tool to screen several compounds in a large variety of food matrices. In this work, ultrahigh-performance liquid chromatography coupled to traveling wave ion mobility spectrometry/quadrupole time-of-flight mass spectrometry (UHPLC-TWIMS-QTOF) was employed to establish the first comprehensive TWIMS-derived collision cross section database (TWCCSN2) for phycotoxins. The database included 20 cyanotoxins and 1 marine toxin. Accurate m/z, retention times, and TWCCSN2 values were obtained for 81 adducts in positive and negative electrospray (ESI+/ESI-) modes. Reproducibility and robustness of the TWCCSN2 measurements were determined to be independent of the matrix. A screening was carried out on 19 commercial BGA dietary supplements of different composition.
AB - The increased consumption of blue-green algae (BGA)-based dietary supplements has raised concern about their food safety, especially about cyanotoxin presence. The hyphenation of liquid chromatography with ion mobility mass spectrometry represents a relevant tool to screen several compounds in a large variety of food matrices. In this work, ultrahigh-performance liquid chromatography coupled to traveling wave ion mobility spectrometry/quadrupole time-of-flight mass spectrometry (UHPLC-TWIMS-QTOF) was employed to establish the first comprehensive TWIMS-derived collision cross section database (TWCCSN2) for phycotoxins. The database included 20 cyanotoxins and 1 marine toxin. Accurate m/z, retention times, and TWCCSN2 values were obtained for 81 adducts in positive and negative electrospray (ESI+/ESI-) modes. Reproducibility and robustness of the TWCCSN2 measurements were determined to be independent of the matrix. A screening was carried out on 19 commercial BGA dietary supplements of different composition.
KW - BGA dietary supplements
KW - CCS database
KW - collision cross section
KW - cyanotoxins
KW - ion mobility mass spectrometry
KW - phycotoxins
U2 - 10.1021/acs.jafc.3c01060
DO - 10.1021/acs.jafc.3c01060
M3 - Article
C2 - 37347990
AN - SCOPUS:85164240087
SN - 0021-8561
VL - 71
SP - 10178
EP - 10189
JO - Journal of Agricultural and Food Chemistry
JF - Journal of Agricultural and Food Chemistry
IS - 26
ER -
