Phenyl {chemometrics} | R Documentation

## Phenyl data set

### Description

The data consist of mass spectra from 600 chemical compounds, where 300 contain a phenyl substructure (group 1) and 300 compounds do not contain this substructure (group 2). The mass spectra have been transformed to 658 variables, containing the mass spectral features. The 2 groups are coded as -1 (group 1) and +1 (group 2), and is provided as first last variable.

### Usage

    data(Phenyl)

### Format

A data frame with 600 observations on the following 659 variables.

`grp`
  a numeric vector
`spec.V1`
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`spec.V2`
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`spec.V574`
  a numeric vector
`spec.V575`
  a numeric vector
`spec.V576`
  a numeric vector
`spec.V577`
  a numeric vector
`spec.V578`
  a numeric vector
`spec.V579`
  a numeric vector
`spec.V580`
  a numeric vector
`spec.V581`
  a numeric vector
`spec.V582`
  a numeric vector
`spec.V583`
  a numeric vector
`spec.V584`
  a numeric vector
`spec.V585`
  a numeric vector
`spec.V586`
  a numeric vector
`spec.V587`
  a numeric vector
`spec.V588`
  a numeric vector
`spec.V589`
  a numeric vector
`spec.V590`
  a numeric vector
`spec.V591`
  a numeric vector
`spec.V592`
  a numeric vector
`spec.V593`
  a numeric vector
`spec.V594`
  a numeric vector
`spec.V595`
  a numeric vector
`spec.V596`
  a numeric vector
`spec.V597`
  a numeric vector
`spec.V598`
  a numeric vector
`spec.V599`
  a numeric vector
`spec.V600`
  a numeric vector
`spec.V601`
  a numeric vector
`spec.V602`
  a numeric vector
`spec.V603`
  a numeric vector
`spec.V604`
  a numeric vector
`spec.V605`
  a numeric vector
`spec.V606`
  a numeric vector
`spec.V607`
  a numeric vector
`spec.V608`
  a numeric vector
`spec.V609`
  a numeric vector
`spec.V610`
  a numeric vector
`spec.V611`
  a numeric vector
`spec.V612`
  a numeric vector
`spec.V613`
  a numeric vector
`spec.V614`
  a numeric vector
`spec.V615`
  a numeric vector
`spec.V616`
  a numeric vector
`spec.V617`
  a numeric vector
`spec.V618`
  a numeric vector
`spec.V619`
  a numeric vector
`spec.V620`
  a numeric vector
`spec.V621`
  a numeric vector
`spec.V622`
  a numeric vector
`spec.V623`
  a numeric vector
`spec.V624`
  a numeric vector
`spec.V625`
  a numeric vector
`spec.V626`
  a numeric vector
`spec.V627`
  a numeric vector
`spec.V628`
  a numeric vector
`spec.V629`
  a numeric vector
`spec.V630`
  a numeric vector
`spec.V631`
  a numeric vector
`spec.V632`
  a numeric vector
`spec.V633`
  a numeric vector
`spec.V634`
  a numeric vector
`spec.V635`
  a numeric vector
`spec.V636`
  a numeric vector
`spec.V637`
  a numeric vector
`spec.V638`
  a numeric vector
`spec.V639`
  a numeric vector
`spec.V640`
  a numeric vector
`spec.V641`
  a numeric vector
`spec.V642`
  a numeric vector
`spec.V643`
  a numeric vector
`spec.V644`
  a numeric vector
`spec.V645`
  a numeric vector
`spec.V646`
  a numeric vector
`spec.V647`
  a numeric vector
`spec.V648`
  a numeric vector
`spec.V649`
  a numeric vector
`spec.V650`
  a numeric vector
`spec.V651`
  a numeric vector
`spec.V652`
  a numeric vector
`spec.V653`
  a numeric vector
`spec.V654`
  a numeric vector
`spec.V655`
  a numeric vector
`spec.V656`
  a numeric vector
`spec.V657`
  a numeric vector
`spec.V658`
  a numeric vector

### Details

The data set can be used for classification in high dimensions.

### Source

K. Varmuza and P. Filzmoser: Introduction to Multivariate Statistical Analysis in Chemeometrics. CRC Press, Boca Raton, FL, 2009.

### References

K. Varmuza and P. Filzmoser: Introduction to Multivariate Statistical Analysis in Chemeometrics. CRC Press, Boca Raton, FL, 2009.

### Examples

    data(Phenyl)
    str(Phenyl)

[Package chemometrics version 0.6 Index]