Mnova Gears – MANIQ

Mnova Automatic NMR Identification and Quantification of compounds in a sample

Manually interpreting NMR data from mixtures is time-consuming, especially when signals overlap or dealing with larger sample batches.

MANIQ is an automated workflow that quickly and accurately processes NMR data from mixtures or pure compounds. It uses robust algorithms to identify and quantify compounds based on a reference library, delivering all the information you need with one click in various formats.

MANIQ has customizable methods to analyze spectra, including the ability to process overlapped NMR peaks in complex samples where no isolated signals or multiplets are found. Contact us if you’re interested in learning more.

Software Solution for Chemical Reaction Optimization



  • Off-the-shelf solution that can be quickly implemented in your environment and customized to your particular needs, regardless of your NMR instrument vendor or data formats.
  • It offers a wide range of analysis possibilities thanks to the use of reference libraries that can be changed and adapted for each analysis.
  • Comprehensive and ready-to-share reports which reduce the time spent on data management.
  • Enhanced compliance with Gxp and data management standards with minimal effort.
  • All your essential mixture analysis tools (MANIQ, SMA*, DB*, NMR Prediction* and verification*) in one software package with powerful automatization capabilities.


    *Requires a valid license



  • Batch and real-time analysis and reporting capabilities adaptable to high-throughput and continuous workflows.
  • Flexible compound identification (Direct Peak Search, Cosine Similarity, Pearson Correlation Coefficient, 13C Analysis) and quantification (Integral Transforms, f-Factor) methods, to accommodate multiple use cases (mixture sample, overlapping peaks, shifting peaks, etc.).
  • Powerful pattern-matching between each sample and a reference library.
  • Relative and absolute quantification options with possibilities to use internal or external (PULCON) references.
  • Very simple and intuitive building of a reference library as an Mnova document with all your reference spectra and molecular structures.
  • Gxp-compliant reports generated seamlessly and saved at your desired location at the end of each analysis.
  • Color-coded results tables for quick review and decision making.
  • Integration with Mgears Viewer, which allows an enhanced review of the results.

Related applications

Mixture analyses with Mnova

Mnova offers multiple ways to address the analyses of mixtures when presented in NMR spectra, whether they are targeted or untargeted, and whether they require component identification and/or quantification. The most suitable technique depends upon the application.

Discover which solution is best for your needs! And Contact us for more information.


Academic, Government & Industrial


Who should be using MANIQ?

Researchers, analytical chemists, expert spectroscopists, and quality control experts in the following market fields:

  • Food and beverage industries (nutraceuticals, foods, wines, fruit juices, etc.)
  • Pharmaceutical industries
  • Personal care and cosmetics
  • Fine chemical synthesis industries
  • Research and analytical labs
  • Contract Research Organizations (CROs) offering mixture analysis services

  • Deformulation of formulated products (drugs, food additives, detergents, dyes, etc.)
  • Quality control of finished consumer products, medicines, vaccines, etc.
  • Fraud detection
  • Detection, identification, and quantification of illicit drugs

The project is supported by and co-financed with FEDER funds within the framework of the Pluriregional Operational Program of Spain (POPE) 2014-2020. (El proyecto impulsado por está cofinanciado con fondos FEDER en el marco del Programa Operativo Plurirregional de España (POPE) 2014-2020).