For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
(2S,3S)-3-(4-METHOXYPHENYLAMINO)-4,4,5,5,5-PENTAFLUORO-2-METHYLPENTAN-1-OL
SpectraBase Compound ID HMFO2IzgdkM
InChI InChI=1S/C13H16F5NO2/c1-8(7-20)11(12(14,15)13(16,17)18)19-9-3-5-10(21-2)6-4-9/h3-6,8,11,19-20H,7H2,1-2H3/t8-,11-/m0/s1
InChIKey LQVMALBOYZMFOX-KWQFWETISA-N
Mol Weight 313.27 g/mol
Molecular Formula C13H16F5NO2
Exact Mass 313.11012 g/mol
Enantiomer InChIKey LQVMALBOYZMFOX-LDYMZIIASA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent Unknown
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent Unknown
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
  • (2R*,3R*)-4,4,5,5,5-PENTAFLUORO-3-(4-METHOXYANILINO)-2-METHYL-1-BUTANOL
  • (+/-)-(2S*,3S*)-4,4,5,5,5-PENTAFLUORO-3-(4-METHOXYANILINO)-2-METHYL-PENTAN-1-OL
Title Journal or Book Year
Highly Enantioselective Synthesis of Fluorinated γ-Amino Alcohols through Proline-Catalyzed Cross-Mannich Reaction Organic Letters 2005
New Strategy for the Stereoselective Synthesis of Fluorinated β-Amino Acids The Journal of Organic Chemistry 2002
First Highly Diastereoselective Synthesis of syn α-Methyl β-Fluoroalkyl β-Amino Esters Organic Letters 1999

This compound is available in the following databases:

KnowItAll NMR Spectral Library

Author: Wiley

The KnowItAll NMR Spectral Library offers a comprehensive collection of NMR reference spectra, including NMR, CNMR, and XNMR, and covers a wide range of compounds including organics, polymers, monomers, metabolites, and more. Learn more.

Unknown Identification

Search your unknown spectrum against the world's largest collection of reference spectra

KnowItAll Campus Solutions

KnowItAll offers faculty and students at your school access to all the tools you need for spectral analysis and structure drawing & publishing! Plus, access the world's largest spectral library.