Sewage Sludge (SRM 2781) analysis using IonDecon and FluoroMatch

Description

This dataset is the first application of our IonDecon (all-ions deconvolution) software. The software allows for deconvolution of all-ions data and use of data with FluoroMatch, LipidMatch, or PolyMatch. This data is for NIST SRM 2781: Domestic Sludge acquired on the Agilent Revident quadrupole time-of-flight LC/MS (LC/Q-TOF).

Citations

Koelmel, J.P.; Kummer, M.; Chevallier, O.; Hindle, R.; Hunt, K.; Camacho, C.G.; Abril, N.; Gill, E.L.; Beecher, C.W.W.; Garrett, T.J.; Yost, R.A.; Townsend, T.G.; Klein, C.; Rennie, E.E.; Bowden, J.A.; Godri Pollitt, K.J. Expanding Per- and Polyfluoroalkyl Substances Coverage in Nontargeted Analysis Using Data-Independent Analysis and IonDecon. J. Am. Soc. Mass Spectrom. 2023, 34 (11), 2525-2537. DOI: 10.1021/jasms.3c00244.

Acknowledgements

Deconvolution Software: Michael kummer

Sample prepration: Camden Camacho, John Bowden’s Lab

Data acquisition: Olivier Chevallier

Instrument: Agilent Revident quadrupole time-of-flight LC/MS (LC/Q-TOF)