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(2S,3S)-3-(4-METHOXYPHENYLAMINO)-2-BENZYL-4,4,4-TRIFLUOROBUTAN-1-OL
SpectraBase Compound ID 7BCJfcJxh4M
InChI InChI=1S/C18H20F3NO2/c1-24-16-9-7-15(8-10-16)22-17(18(19,20)21)14(12-23)11-13-5-3-2-4-6-13/h2-10,14,17,22-23H,11-12H2,1H3/t14-,17+/m0/s1
InChIKey HQNNACLJRQHIMI-WMLDXEAASA-N
Mol Weight 339.36 g/mol
Molecular Formula C18H20F3NO2
Exact Mass 339.144613 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EwPcqZxHqqT
Name (2S,3S)-3-(4-METHOXYPHENYLAMINO)-2-BENZYL-4,4,4-TRIFLUOROBUTAN-1-OL
Compound Number 2F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H20F3NO2
InChI InChI=1S/C18H20F3NO2/c1-24-16-9-7-15(8-10-16)22-17(18(19,20)21)14(12-23)11-13-5-3-2-4-6-13/h2-10,14,17,22-23H,11-12H2,1H3/t14-,17+/m0/s1
InChIKey HQNNACLJRQHIMI-WMLDXEAASA-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 339.358 g/mol
Sample ID 57732
Solvent CDCl3