Influence of physical factors on the accuracy of calibration models for NIR spectroscopy

Blanco, M.; Peguero, Anna

doi:10.1016/j.jpba.2009.12.009

Cited by 47 publications

(21 citation statements)

References 11 publications

Supporting

Mentioning

Contrasting

Order By: Relevance

“…Among the models presented in Table III, it can be seen that for ascorbic acid, model (j) has better prediction ability than other models. The (j) model has higher values for R 2 and lower values for RMSECV and bias than other models, notably models (g), (h) and (k). At the same time, it can be seen also in Table III, that for sodium ascorbate, model (h) is the model with a better prediction ability.…”

Section: Ascorbic Acid and Sodium Ascorbate Assay In Powder Blends Fomentioning

confidence: 92%

Quantification of ascorbic acid and sodium ascorbate in powder blends for tableting and in vitamin C chewable tablets by NIR-chemometry

Tomuță¹,

Dudaş²,

Vonica³

et al. 2013

Acta Pharmaceutica

View full text Add to dashboard Cite

Pharmaceutical controls are time-consuming and require extensive sample preparation. Process analytical technology (PAT) implementation in the pharmaceutical industry would reduce these time consuming operations. To perform this implementation, the use of analytical techniques capable of providing accurate results in a simple and rapid manner is necessary (1). Other advantages include little or no sample preparation (2, 3). Near infrared spectrophotometry (NIR) is a non-destructive and non-invasive technique that allows determination of chemical properties such as active pharmaceutical ingredient (API) or excipient content. The paper proposes a near infrared method able to directly and simultaneously quantify ascorbic acid and sodium ascorbate in powder blends for tableting and in vitamin C chewable tablets without any sample preparation. In the first step, calibration models for the quantification of ascorbic acid and sodium ascorbate in powder blends for tableting and subsequently in chewable vitamin C tablets (corresponding to 80-120 % active substance) were developed according to an experimental design with 2 variables and 5 levels. Then, using the best calibration models, the methods were fully validated in terms of recovery, precision and accuracy for both powder blends and vitamin C chewable tablets. NIR spectroscopy can be used to perform quantitative determinations of one, two or more compounds in complex matrices like, for instance, a pharmaceutical powder blend for tableting or tablets. A NIR assay method is usually not developed in the »traditional« way as UV spectrometry or HPLC assay methods (4). A major step to develop a NIR assay method is the calibration procedure for model development. Once calibration is developed and favourable predictions are expected, they must be validated to be accepted for routine use. For external validation, independent sets of samples are needed. There are several validation parameters that must be determined in order to be consistent with the recommendations of official guidelines: accuracy, precision (repeatability and intermediate precision), specificity, linearity and range of application (5, 6).Many papers report the determination of API content in powder blends or tablets by NIR methods (6, 7), but only a few are focused on the prediction of two or more APIs and/or excipients combined in powder blends or tablets (8, 9).The methods currently used to determine the amount of ascorbic acid and sodium ascorbate in tablets or powder blends for tableting are HPLC (10, 11) and titrimetry (12, 13), but they have the disadvantage of being rather time-consuming. Unlike the conventional methods, NIR-chemometric methods are faster and do not require prior preparation of the sample, so they can be a viable alternative for direct quantification of ascorbic acid and sodium ascorbate in powder blends for tableting and vitamin C tablets. The first objective of our research was to develop a NIR-chemometric method suitable for direct quantification of both APIs from powder blends f...

show abstract

Section: Ascorbic Acid and Sodium Ascorbate Assay In Powder Blends Fomentioning

confidence: 92%

Quantification of ascorbic acid and sodium ascorbate in powder blends for tableting and in vitamin C chewable tablets by NIR-chemometry

Tomuță¹,

Dudaş²,

Vonica³

et al. 2013

Acta Pharmaceutica

View full text Add to dashboard Cite

show abstract

“…The process spectrum is an approach towards including this future variation in a simple efficient manner. The process spectrum approach takes into consideration that during a pharmaceutical manufacturing process the chemical composition is often practically constant and the main changes are in the physical properties of samples [66][67][68]. The components in the formulation may be mixed or wet granulated increasing the particle size and changing the moisture content.…”

Section: Process Spectrum Approachmentioning

confidence: 99%

A Procedure for Developing Quantitative Near Infrared (NIR) Methods for Pharmaceutical Products

Romañach

Román-Ospino

Alcalà

2016

Methods in Pharmacology and Toxicology

View full text Add to dashboard Cite

The pharmaceutical industry uses procedures to describe all the instructions needed to perform a process in a consistent manner. Procedures are based on process knowledge and the desire to consistently meet desired specifications. This chapter proposes a procedure for the development of NIR partial least squares (PLS) calibration models for pharmaceutical applications. The chapter captures the lessons learned for more than a decade in studies where NIR spectroscopy has been used for quantitative determinations of drug concentration, moisture, polymorphs, and other important applications. Two examples of recent initiatives to develop NIR calibration models in a more efficient manner reducing the number of calibration samples are also discussed. The procedure differs from previously published guidelines since it is based on specific examples of method validations for pharmaceutical processes and provides clear instructions for method development and validation. The procedure and tutorial should advance the implementation of near infrared spectroscopic (NIRS) quantitative methods in the pharmaceutical industry.

show abstract

“…These chemometric measures were used to validate NIRS method to quantify active principal ingredients (API) in tablets [15][16][17][18][19][20][21][22] or powder blends [23,24] as well as excipients in tablets [15,18,22] or powder blends [23], for the quantification of API in injection samples [25] for the determination of adjuvant in vaccines [26], for the quantification of traditional Chinese medicine extracts in intermediates of drug products [27], to quantify the amount protein in controlled release matrix [28], to assess several steps of tableting process [29][30][31] or other processes [32], in commercial alginate powders [33], of polymorphs within API [34][35][36], drug substance in human plasma [37], to monitor on-line blend uniformity of pharmaceutical solid dosage forms [38] or for the monitoring API concentration in powder mixing process [39], to measure water content in various drug products [40][41][42][43][44]. These examples of application of NIRS in pharmaceutical applications demonstrate, if it still needs to, the broad applicability of such techniques in the development and control of pharmaceutical drug products.…”

Section: Traditional Chemometric Validationmentioning

confidence: 99%

Critical review of near-infrared spectroscopic methods validations in pharmaceutical applications

Bleye

Chavez

Mantanus

et al. 2012

Journal of Pharmaceutical and Biomedical Analysis

109

View full text Add to dashboard Cite

Influence of physical factors on the accuracy of calibration models for NIR spectroscopy

Cited by 47 publications

References 11 publications

Quantification of ascorbic acid and sodium ascorbate in powder blends for tableting and in vitamin C chewable tablets by NIR-chemometry

Quantification of ascorbic acid and sodium ascorbate in powder blends for tableting and in vitamin C chewable tablets by NIR-chemometry

A Procedure for Developing Quantitative Near Infrared (NIR) Methods for Pharmaceutical Products

Critical review of near-infrared spectroscopic methods validations in pharmaceutical applications

Contact Info

Product

Resources

About