Quantification of soybean biodiesels in diesel blends according to ASTM E1655 using mid-infrared spectroscopy and multivariate calibration

• Published in: Fuel (Guildford) 2014-01, Vol.117, p.1111-1114
• Main Authors: Gontijo, Lucas Caixeta, Guimarães, Eloiza, Mitsutake, Hery, Santana, Felipe Bachion de, Santos, Douglas Queiroz, Borges Neto, Waldomiro
• Format: Article
• Language: English
• Subjects: Biodiesel; Blends; Chemometrics; Diesel; Diesel fuels; Infrared spectroscopy; Multivariate calibration; Polymer blends; Soybeans; Spectra
• ISSN: 0016-2361; 1873-7153
• DOI: 10.1016/j.fuel.2013.10.043

•Quantification of biodiesels in diesel by FTMIR–HATR using the whole spectrum.•The models are capable of determining biodiesel in a diesel using a single concentration range.•The accuracy of the proposed models is one tenth of the recommended by the Brazilian standard method.•Proposed models can be employed to determine both methyl and ethyl biodiesels in diesel blends. This study evaluated the use of partial-least-squares (PLS) regression models to quantify soybean biodiesels in diesel blends. The study was carried out by taking into account the entire mid-infrared spectral range and according to the ASTM E1655 standard. The PLS models provided low root-mean-squared errors of prediction (RMSEP) of 0.0792% (v/v) and 0.1050% (v/v) for the models containing methyl and ethyl soybean biodiesels, respectively. In addition, an excellent correlation was observed in the prediction set (R=0.9999), and no systematic errors were present according to the ASTM E1655 standard. When the models were compared against the requirements of the ABNT NBR 15568 standard, both models exhibited adequate accuracy both the concentration ranges from 0% to 8% and 8 to 30% (v/v). Therefore, the proposed models for the entire spectral region allow the determination of both methyl and ethyl soybean biodiesels in diesel using only the concentration range between 1.00% and 30.00% (v/v).