ssb_offset {SOMnmR}

Spinnning side bands ofset calculation function This function calculates the spinning side band ofset for a given 13C NMR table. The function returns the 13C NMR integration table to be used in the int_nmr function.

Description

Spinnning side bands ofset calculation function This function calculates the spinning side band ofset for a given 13C NMR table. The function returns the 13C NMR integration table to be used in the int_nmr function.

Usage

ssb_offset(NMRmeth = NULL, NMR_field = NULL, NMR_rotation = NULL)

Arguments

NMRmeth

Regions to be integrated, methods available include: "4region", "Bonanomi", "Smernik" and Molecular mixing model ("MMM").

NMR_field

Magnetic field of the NMR

NMR_rotation

Rotation frequency of the sample probe in the NMR

Value

A dataframe containing the integral regions of the NMR spectrometer (according to the NMR spectrometer field and rotation speed) using the selected method and the predicted regions of the SSBs.

Examples

see_offset <- ssb_offset (NMRmeth='4region', NMR_field = 200, NMR_rotation = 6800)