get_exactmass

Get the exact mass for chemical formulas.

High resolution mass spectrometry yields often large data sets of
spectra from compounds which are not present in available libraries. These
spectra need to be annotated and interpreted.
'InterpretMSSpectrum' provides a set of functions to perform such tasks for
Electrospray-Ionization and Atmospheric-Pressure-Chemical-Ionization derived
data in positive and negative ionization mode.

Jan Lisec

InterpretMSSpectrum

Interpreting High Resolution Mass Spectra

Jaeger Carsten

get_exactmass function

<dl><dt>x</dt>
<dd>Vector of chemical formulas.</dd></dl>

Arguments

get_exactmass. — get_exactmass

<dl>

<dt>x</dt>
<dd>Vector of chemical formulas.</dd>

</dl>

get_exactmass: get_exactmass.

Description

Usage

Value

Arguments

Examples