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(2S,3S)-3-(4-METHOXYPHENYLAMINO)-2-ETHYL-4,4,4-TRIFLUOROBUTAN-1-OL
SpectraBase Compound ID EnIUANjA7B1
InChI InChI=1S/C13H18F3NO2/c1-3-9(8-18)12(13(14,15)16)17-10-4-6-11(19-2)7-5-10/h4-7,9,12,17-18H,3,8H2,1-2H3/t9-,12-/m0/s1
InChIKey UEOMMQQBHZAKMU-CABZTGNLSA-N
Mol Weight 277.29 g/mol
Molecular Formula C13H18F3NO2
Exact Mass 277.128963 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HIVKheFdg8R
Name (2S,3S)-3-(4-METHOXYPHENYLAMINO)-2-ETHYL-4,4,4-TRIFLUOROBUTAN-1-OL
Compound Number 2E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H18F3NO2
InChI InChI=1S/C13H18F3NO2/c1-3-9(8-18)12(13(14,15)16)17-10-4-6-11(19-2)7-5-10/h4-7,9,12,17-18H,3,8H2,1-2H3/t9-,12-/m0/s1
InChIKey UEOMMQQBHZAKMU-CABZTGNLSA-N
Literature Reference Author S.FUSTERO,D.LIMENEZ,J.F.SANZ-CERVERA,M.SANCHEZ-ROSELLO,E.EST EBAN,A.SIMON-FUENTES
Literature Reference Citation ORG.LETTERS,7,3433(2005)
Literature Reference DOI 10.1021/ol050791f
Molecular Weight 277.287 g/mol
Sample ID 57731
Solvent CDCl3