Description Usage Arguments Author(s) Examples
View source: R/adduct_formula.R
Get the total formula after add adduct.
1 | sum_formula(formula = "C9H11NO2", adduct = "M-H2O+H")
|
formula |
Chemical formula. |
adduct |
Adduct. |
Xiaotao Shen shenxt@stanford.edu
1 2 3 4 | sum_formula(formula = "C9H11NO2", adduct = 'M+H')
sum_formula(formula = "C9H11NO2", adduct = 'M+')
sum_formula(formula = "C9H11NO2", adduct = 'M+CH3COOH')
sum_formula(formula = "C9H11", adduct = 'M-H20')
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