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Applied Spectroscopy

Applied Spectroscopy

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  • Vol. 49, Iss. 11 — Nov. 1, 1995
  • pp: 1590–1597

Discrimination of Organic Solvents Using an Infrared-Emitting Diode-Based Analyzer. Part I: Feasibility

Anthony S. Bonanno and Peter R. Griffiths

Applied Spectroscopy, Vol. 49, Issue 11, pp. 1590-1597 (1995)


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Abstract

This report demonstrates the feasibility of discriminating organic solvents on the basis of short-wave near-infrared spectra (from 0.7 to 1.1 μm). Both library searching and multivariate statistical methods were applied to 8-cm-1 spectra and to spectra de-resolved to the point achievable with an analyzer using discrete infrared-emitting diode sources. Library searching performed satisfactorily if the unknown and library spectra were collected under reasonably similar conditions, but performed poorly if the temperature of hydrogen-bonding solvents was varied. A multivariate discrimination technique based on Mahalanobis distance computation was capable of discriminating between several alcohols while allowing for a temperature variation of 20°C. These results indicate that a very low resolution (on the order of 100 cm-1) short-wave near-infrared analyzer can achieve successful discrimination between similar solvents under variable conditions.

Citation
Anthony S. Bonanno and Peter R. Griffiths, "Discrimination of Organic Solvents Using an Infrared-Emitting Diode-Based Analyzer. Part I: Feasibility," Appl. Spectrosc. 49, 1590-1597 (1995)
http://www.opticsinfobase.org/as/abstract.cfm?URI=as-49-11-1590

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