Quantitative Raman spectroscopy for the Ioncell™ process. Part 1: comparison of univariate and multivariate calibration methods for the quantification of water and protic ionic liquid components

We investigate in this paper the potential of Raman spectroscopy for the quantification of protic ionic liquid components (acid and base) and water, in ionic liquid/water mixtures, taking 1.5-Diazabicyclo[4.3.0]non-5-enium acetate ([DBNH][OAc]) as a case study. We show that the combination of Raman spectroscopy and chemometrics is quite successful for the quantitative analysis of the ionic liquid components and water in mixtures over wide concentration ranges. The finding of the present work suggest that Raman spectroscopy should be considered more universally for the in-line monitoring and control of processes involving ionic liquid/H 2 O mixtures.

• Publication year

  2019

• Venue

  Cellulose

• Publication date

  2019-11-02

• Fields of study

  Chemistry

• Identifiers
  DOI 10.1007/s10570-019-02809-y
• External record

  Open on Semantic Scholar

• Source metadata

  Semantic Scholar

• No claims are published for this paper.

• No concepts are published for this paper.

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  2012cited by this paper
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  2012cited by this paper
• Infrared and Raman Spectroscopy: Principles and Spectral Interpretation

  2011cited by this paper
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  2010cited by this paper
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  2010cited by this paper
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  2009cited by this paper
• Raman Spectroscopy and Ab-Initio Model Calculations on Ionic Liquids

  2007influential reference
• Modern Raman Spectroscopy - A Practical Approach: Smith/Modern Raman Spectroscopy - A Practical Approach

  2005cited by this paper
• Modern Raman Spectroscopy: A Practical Approach

  2005cited by this paper
• Chemometrics in spectroscopy : Part 2. Examples

  2004cited by this paper
• Quantitative Analysis Using Raman Spectrometry

  2003cited by this paper
• Absorption of Water by Room-Temperature Ionic Liquids: Effect of Anions on Concentration and State of Water

  2003influential reference
• Chemometrics in spectroscopy. Part 1. Classical chemometrics

  2003cited by this paper
• Liquid Structure of Acetic Acid Studied by Raman Spectroscopy and Ab Initio Molecular Orbital Calculations

  1999cited by this paper
• Reaction monitoring using Raman spectroscopy and chemometrics

  1999cited by this paper
• Partial least-squares regression: a tutorial

  1986cited by this paper

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