compInfo: Information of a Compound
In xdomingoal/erah-devel: Automated Spectral Deconvolution, Alignment, and Metabolite Identification in GC/MS-Based Untargeted Metabolomics
compInfo R Documentation
Information of a Compound
Description
Displays basic information of a compound in the MS library.
Usage
compInfo(comp.id, id.database = mslib)
Arguments
comp.id
The DB.Id number of the compound.
id.database
The mass-spectra library to be compared with the empirical spectra. By default, the MassBank - Mass Bank of North America (MoNa) database are employed (mslib object).
Details
Returns details on a given compound such as the synonyms, CAS, KEGG, retention index, among others.
See Also
findComp
Examples
# finding proline
findComp("proline")
# we see that proline 2TMS has the DB.Id number 42, then:
compInfo(42)
xdomingoal/erah-devel documentation built on Feb. 11, 2024, 11:11 a.m.
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| compInfo | R Documentation |
Information of a Compound
Description
Displays basic information of a compound in the MS library.
Usage
compInfo(comp.id, id.database = mslib)
Arguments
comp.id |
The DB.Id number of the compound. |
id.database |
The mass-spectra library to be compared with the empirical spectra. By default, the MassBank - Mass Bank of North America (MoNa) database are employed (mslib object). |
Details
Returns details on a given compound such as the synonyms, CAS, KEGG, retention index, among others.
See Also
findComp
Examples
# finding proline
findComp("proline")
# we see that proline 2TMS has the DB.Id number 42, then:
compInfo(42)
R Package Documentation
Browse R Packages
We want your feedback!
Note that we can't provide technical support on individual packages. You should contact the package authors for that.
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