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4-Fluoro-α-pyrrolidinopentiophenone
SpectraBase Compound ID HAFvCWHbbrK
InChI InChI=1S/C15H20FNO/c1-2-5-14(17-10-3-4-11-17)15(18)12-6-8-13(16)9-7-12/h6-9,14H,2-5,10-11H2,1H3
InChIKey BQLSUBYYRRZHRK-UHFFFAOYSA-N
Mol Weight 249.33 g/mol
Molecular Formula C15H20FNO
Exact Mass 249.152892 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID 3kR50G0yR5Z
Name 4-Fluoro-α-pyrrolidinopentiophenone
Source of Sample Cayman Chemical Company
Catalog Number Free base of 15166
Lot Number Free base of 0453912-21
Accessory DurasamplIR II
Acronyms 4-Fluoro-α-PVP
CAS Registry Number 850352-62-4
Copyright Copyright © 2019-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H20FNO
IUPAC Name 1-(4-Fluorophenyl)-2-(1-pyrrolidinyl)-1-pentanone
InChI InChI=1S/C15H20FNO/c1-2-5-14(17-10-3-4-11-17)15(18)12-6-8-13(16)9-7-12/h6-9,14H,2-5,10-11H2,1H3
InChIKey BQLSUBYYRRZHRK-UHFFFAOYSA-N
Instrument Name Bio-Rad FTS
Molecular Weight 249.329 g/mol
SMILES c1(F)ccc(C(=O)C(N2CCCC2)CCC)cc1
Sample Preparation Procedure The HCl salt was dissolved in 0.5 mL water in a test tube, and 1 drop of 30% NaOH solution was added, causing the clear solution to turn cloudy white. 1 mL dichloromethane was added to the test tube, which was shaken thoroughly using a vortex mixer. The test tube was spun in a centrifuge to separate the organic and aqueous layers. The bottom organic layer was retrieved with a pipette and placed in another clean test tube. Most of the solvent was evaporated from the tube using a flow of nitrogen gas, and the remaining solution was used to create a film on the diamond window for ATR-IR.
Solvent Dichloromethane
Source of Spectrum Forensic Spectral Research
Synonyms 4-Fluoro-α-pyrrolinovalerophenone; 4-Fluoro-2-(1-pyrrolidinyl)valerophenone
Technique ATR-Film