MARIA CARMELA EMANUELE

PhD Graduate

PhD program:: XXXVIII


supervisor: Prof.ssa Luisa Mannina

Thesis title: Benchtop FT-NMR a versatile tool for customs applications and food challenges

This doctoral thesis explores the application of low-field benchtop nuclear magnetic resonance spectroscopy based on Fourier transform (Benchtop FT-NMR), used as an innovative technology for the identification and quantification of substances in customs, forensic, and food sectors. Both one- and two-dimensional spectra of various nuclei (¹H, ¹³C, ¹⁹F, ²³Na) were employed. The work is divided into two main sections: the first focuses on forensic analysis and the control of narcotic substances; the second is dedicated to food and environmental authentication and safety. Through collaboration with the Joint Research Centre (JRC) of the European Commission and the network of European customs laboratories (CLEN), official national customs analytical methods (MADs) have been developed and are currently under validation. These include the detection of food fraud, adulterants in fuels and food, and the identification and quantification of drugs of abuse. Additionally, the research enabled the identification of new psychoactive substances (NPS), precursors of synthetic drugs (such as IMDPAM, PMK, and BMK), SARMs used in sports doping, and fluorinated gases. The installation of 15 Benchtop FT-NMR spectrometers (80 MHz- Magritek Mod. Spinsolve HF Multi-X Nuclei Ultra) in Italian customs laboratories led to the creation of a national network of 53 chemists, supported by training courses, proficiency tests, and standardized operating protocols. This initiative facilitated the development of MADs and laid the groundwork for the creation of an LFNMR database, aimed at the rapid identification of frauds, adulterations, and unknown substances. The results demonstrate that Benchtop FT-NMR is a reliable, cost-effective, and fast tool, capable of providing both qualitative and quantitative analyses even in complex matrices, significantly contributing to public health protection, food safety, and the fight against commercial fraud.

Research products

11573/1741596 - 2025 - Identification and investigation of the intrinsic receptor activation potential and metabolization of the new oxo-pyridyl synthetic cannabinoid receptor agonist CH-FUBBMPDORA
Deventer, Marie H.; Emanuele, Maria Carmela; Stang, Brianna N.; Van Uytfanghe, Katleen; Masson, Jessica; Bouvot, Xavier; Lamoureux, Catherine; Proposito, Alessandro; Reniero, Fabiano; Holland, Margaret V.; Krotulski, Alex J.; Mannina, Luisa; Stove, Christophe P.; Guillou, Claude - 01a Articolo in rivista
paper: DRUG TESTING AND ANALYSIS (Chichester, UK : John Wiley & Sons c2009-) pp. 1-17 - issn: 1942-7603 - wos: WOS:001419145600001 (2) - scopus: 2-s2.0-85217631571 (2)

11573/1739418 - 2025 - Current applications of benchtop FT-NMR in food science. From quality control to adulteration detection
Di Matteo, Giacomo; Grassi, Silvia; Emanuele, Maria Carmela; Scioli, Giuseppe; Brigante, Federico Ivan; Bontempo, Luana; Ingallina, Cinzia; Guillou, Claude; Sobolev, Anatoly P.; Mannina, Luisa - 01g Articolo di rassegna (Review)
paper: FOOD RESEARCH INTERNATIONAL (Elsevier Applied Science:An Imprint of Elsevier Science Ltd, The Boulevard, Langford Lane, Kidlington Oxford OX5 1GB United Kingdom:011 44 1865 843000, 011 44 1865 843699, EMAIL: nlinfo-f@elsevier.nl OR usinfo-f@elsevier.com OR forinfo-kyf04035@niftyserve.or.jp, INTERNET: http://www.elsevier.nl/, Fax: 011 44 1865 843010) pp. 1-19 - issn: 0963-9969 - wos: WOS:001465004200001 (3) - scopus: 2-s2.0-105001976556 (4)

11573/461473 - 2012 - Fingerprint of special edible oils using a widespread analytical protocol
Cesa, Stefania; Casini, Antonio; Botta, Bruno; D., Capitani; Di Cocco, Maria Enrica; M. C., Emanuele; M., Gobbino; Mannina, Luisa; A. P., Sobolev; S., Vista; Vitale, Marcello - 04c Atto di convegno in rivista
paper: EMIRATES JOURNAL OF FOOD AND AGRICULTURE (Al Ain : Faculty of Food and Agriculture, United Arab Emirates University) pp. 64-64 - issn: 2079-052X - wos: (0) - scopus: (0)
conference: ChimAlSi_2012 IX Italian Congress of Food Chemistry (Ischia, Italy)

11573/461272 - 2012 - Nuclear magnetic resonance study of flavoured olive oils
Mannina, Luisa; Marco, D'imperio; Marco, Gobbino; Irene, D'amico; Casini, Antonio; Maria Carmela, Emanuele; Anatoly P., Sobolev - 01a Articolo in rivista
paper: FLAVOUR AND FRAGRANCE JOURNAL (John Wiley & Sons Limited:1 Oldlands Way, Bognor Regis, P022 9SA United Kingdom:011 44 1243 779777, EMAIL: cs-journals@wiley.co.uk, INTERNET: http://www.wiley.co.uk, Fax: 011 44 1243 843232) pp. 250-259 - issn: 0882-5734 - wos: WOS:000302995800007 (20) - scopus: 2-s2.0-84859963154 (21)

11573/43086 - 2000 - Concentration dependence of 13C NMR spectra of triglycerides: implications for the NMR analysis of olive oils
Mannina, Luisa; C., Luchinat; M., Patumi; M. C., Emanuele; E., Rossi; A. L., Segre - 01a Articolo in rivista
paper: MAGNETIC RESONANCE IN CHEMISTRY (John Wiley & Sons Limited:1 Oldlands Way, Bognor Regis, P022 9SA United Kingdom:011 44 1243 779777, EMAIL: cs-journals@wiley.co.uk, INTERNET: http://www.wiley.co.uk, Fax: 011 44 1243 843232) pp. 886-890 - issn: 0749-1581 - wos: WOS:000089723900014 (41) - scopus: 2-s2.0-0034288840 (47)

11573/46875 - 1999 - STUDIO SULLA SOFISTICAZIONE DELL'OLIO DI OLIVA CON OLIO DI NOCCIOLA
M. C., Emanuele; Mannina, Luisa; M., Patumi; A., Segre - 01a Articolo in rivista
paper: OLIVO & OLIO (Bologna: Edagricole; Milano: Gruppo 24 ore business media Bologna: Edagricole) pp. 48-55 - issn: 1127-0713 - wos: (0) - scopus: (0)

11573/502276 - 1999 - Full Assignment of 13C NMR Spectra of Vegetable Oils: Biochemical Implication
Mannina, Luisa; C., Luchinat; M. C., Emanuele; A. L., Segre - 04d Abstract in atti di convegno
conference: ASAE/CSAE-SCGR Annual International Meeting (Toronto (Canada),)

11573/434879 - 1999 - Acyl positional distribution of glycerol tri-esters in vegetable oils: a 13C NMR study
Mannina, Luisa; C., Luchinat; M. C., Emanuele; A., Segre - 01a Articolo in rivista
paper: CHEMISTRY AND PHYSICS OF LIPIDS (Elsevier Science Ireland Limited:PO Box 85, Limerick Ireland:011 353 61 709600, 011 353 61 61944, EMAIL: usinfo-f@elsevier.com, INTERNET: http://www.elsevier.com, Fax: 011 353 61 709114) pp. 47-55 - issn: 0009-3084 - wos: (0) - scopus: 2-s2.0-0032741144 (83)

11573/46874 - 1999 - OLIVE AND HAZELNUT OILS: A STUDY BY HIGH-FIELD 1H NMR AND GAS CHROMATOGRAPHY”
Mannina, Luisa; M., Patumi; P., Fiordiponti; M. C., Emanuele; A. L., Segre - 01a Articolo in rivista
paper: ITALIAN JOURNAL OF FOOD SCIENCE (Pinerolo To Italy: Chiriotti Editori Spa) pp. 139-149 - issn: 1120-1770 - wos: (0) - scopus: 2-s2.0-0041031330 (61)

11573/94868 - 1998 - Early detection of enzymatic attack on paper by NMR relaxometry, EPR Spectrometry and X-rays power spectra.
D., Capitani; M. C., Emanuele; A. L., Segre; Fanelli, Corrado; Fabbri, Anna Adele; D., Attanasio; B., Focher; G., Capretti - 01a Articolo in rivista
paper: NORDIC PULP & PAPER RESEARCH JOURNAL (Mentor Communications AB:Box 72001, S 18172 Lindigo Sweden:011 46 8 6704128, EMAIL: birgitta.a@mentoronline.se, INTERNET: http://www.mentoronline.se, Fax: 011 46 8 6616455) pp. 95-100 - issn: 0283-2631 - wos: (0) - scopus: (0)

11573/46873 - 1998 - L'OLIO DI OLIVA E LA RISONANZA MAGNETICA NUCLEARE PROTONICA AD ALTO CAMPO
M. C., Emanuele; Mannina, Luisa; M., Patumi; A., Segre - 01a Articolo in rivista
paper: OLIVO & OLIO (Bologna: Edagricole; Milano: Gruppo 24 ore business media Bologna: Edagricole) pp. 53-57 - issn: 1127-0713 - wos: (0) - scopus: (0)

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