Description Usage Arguments Value 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. |
formula
Xiaotao Shen shenxt1990@outlook.com
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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