The effects of elevated temperature (up to 140 degrees C) and pressure (up to 500 psi) on the Fourier transform near-infrared (FT-NIR) spectra of monoalkylated light alkenes and the feasibility of quantitative determination of these compounds were investigated via fiber-optic FT-NIR spectroscopy, The effects of elevated pressures on spectra were found to be insignificant, However, the temperature effects were critical, especially for the lighter molecules such as ethylene and propylene, Therefore, the determination of these compounds at elevated temperatures requires the incorporation of the temperature effects into the calibration model, An apparatus to collect the spectra of these compounds at elevated temperatures and pressures by fiber-optic FT-NIR spectroscopy was constructed, The determination of ethylene and 1-octene was evaluated, Calibration models were built by using partial least-squares (PLS) regressions, Standard errors of prediction values were <0.5 wt % for both ethylene and 1-octene, and the absolute error of determination for alkenes is expected to be less than +/-0.75 wt %.
机构:
Johnson & Johnson Pharmaceut Res & Dev LLC, Analyt Dev, Spring House, PA 19477 USAJohnson & Johnson Pharmaceut Res & Dev LLC, Analyt Dev, Spring House, PA 19477 USA
Li, Weiyong
Johnson, Mark C.
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机构:Johnson & Johnson Pharmaceut Res & Dev LLC, Analyt Dev, Spring House, PA 19477 USA
Johnson, Mark C.
Bruce, Rick
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机构:Johnson & Johnson Pharmaceut Res & Dev LLC, Analyt Dev, Spring House, PA 19477 USA
Bruce, Rick
Ulrich, Steven
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机构:Johnson & Johnson Pharmaceut Res & Dev LLC, Analyt Dev, Spring House, PA 19477 USA
Ulrich, Steven
Rasmussen, Henrik
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机构:Johnson & Johnson Pharmaceut Res & Dev LLC, Analyt Dev, Spring House, PA 19477 USA
Rasmussen, Henrik
Worosila, Gregory D.
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机构:Johnson & Johnson Pharmaceut Res & Dev LLC, Analyt Dev, Spring House, PA 19477 USA
机构:
ARS, USDA, NCAUR, Peoria, IL 61604, United States
NCAUR, ARS, USDA, 1815 N. University St., Peoria, IL 61604, United StatesARS, USDA, NCAUR, Peoria, IL 61604, United States
Knothe, Gerhard
JAOCS, Journal of the American Oil Chemists' Society,
1999,
76
(07):
: 795
-
800