getmdh: Get the high order unit based Mass Defect

In enviGCMS: GC/LC-MS Data Analysis for Environmental Science

Get the high order unit based Mass Defect

Description

Get the high order unit based Mass Defect

Usage

getmdh(mz, cus = c("CH2,H2"), method = "round")

Arguments

mz	numeric vector for exact mass
cus	chemical formula or reaction
method	you could use 'round', 'floor' or 'ceiling'

Value

high order Mass Defect with details

Examples

## Not run: 
getmdh(getmass('C2H4')))

## End(Not run)

enviGCMS documentation built on April 3, 2025, 11:07 p.m.