LC-HRMS peak list of a sewage treatment plant effluent sample.
Usage
data(peaklist)
Format
Numeric data frame with 11172 observations on the following 3 variables.
mass
Peak m/z
intensity
Peak intensity
rt
Peak retention time [min]
Details
HPLC-ESI-FTMS Thermo Fisher orbitrap, resolution 100.000@400m/z, positive ionization, profile data.
Generated by Thermo Fisher Formulator peak-picking algorithm; contains satellite peaks for some high intensity peaks.
Examples
data(peaklist)
plot(peaklist[,3],peaklist[,1],pch=19,cex=0.5,xlab="Retention time [min]",ylab="m/z")