4F-PBP (4'-fluoro-α-pyrrolidinobutyrophenone), a new substance of abuse: Structural characterization and purity NMR profiling

Forensic Sci Int. 2015 Jul:252:168-76. doi: 10.1016/j.forsciint.2015.05.003. Epub 2015 May 12.

Abstract

The rapidly growing problem of new psychoactive substances (NPS) makes the time management for international control a real challenge, with the traditional detection methods becoming increasingly inadequate. NPS screening technologies, such as NMR, which allows multiple substances to be detected, characterized and quantified simultaneously from a single sample, offers a rapid solution to this problem. This study describes the application of NMR to the simultaneous detection, characterization and quantification of samples of white powders seized by the Portuguese Police. 4F-PBP (4'-fluoro-α-pyrolidinobutyrophenone) a new synthetic psychoactive cathinone cut with myo-inositol was found in two seized products. The structural characterization of 4F-PBP was elucidated in the mixture, and confirmed after isolation from the matrix by (1)H, (13)C, (19)F NMR and MS. Myo-inositol was found for the first time as a cutting agent of cathinones. Furthermore another seized product was characterized as being MDPBP, with a high degree of purity, and its spectroscopic elucidation enabled the correction of (13)C NMR literature assignments.

Keywords: 4F-PBP; Cathinones; Designer drugs; Fluoropyrolidinobutyrophenone; NMR; Pyrolidinophenone; Quantification.

Publication types

  • Research Support, Non-U.S. Gov't

MeSH terms

  • Alkaloids / chemistry*
  • Butyrophenones / chemistry*
  • Drug Contamination
  • Forensic Toxicology
  • Gas Chromatography-Mass Spectrometry
  • Illicit Drugs / chemistry*
  • Inositol / analysis
  • Magnetic Resonance Spectroscopy
  • Molecular Structure
  • Psychotropic Drugs / chemistry*
  • Pyrrolidines / chemistry*

Substances

  • 4'-fluoro-alpha-pyrrolidinobutyrophenone
  • Alkaloids
  • Butyrophenones
  • Illicit Drugs
  • Psychotropic Drugs
  • Pyrrolidines
  • Inositol
  • cathinone