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(2-R,3-S,4-S,5-R)-2-N-BENZYLHYDROXYLAMINE-1,6-DIPHENYL-3,4-O-ISOPROPYLIDENE-5-(N-TRIFLUOROACETYL)-BENZYLAMINE-3,4-HEXANDIOL;MAJOR_ISOMER

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(2-R,3-S,4-S,5-R)-2-N-BENZYLHYDROXYLAMINE-1,6-DIPHENYL-3,4-O-ISOPROPYLIDENE-5-(N-TRIFLUOROACETYL)-BENZYLAMINE-3,4-HEXANDIOL;MAJOR_ISOMER
SpectraBase Compound ID EdBwuobfulP
InChI InChI=1S/C37H39F3N2O4/c1-36(2)45-33(34(46-36)32(24-28-17-9-4-10-18-28)42(44)26-30-21-13-6-14-22-30)31(23-27-15-7-3-8-16-27)41(35(43)37(38,39)40)25-29-19-11-5-12-20-29/h3-22,31-34,44H,23-26H2,1-2H3/t31-,32-,33+,34-/m1/s1
InChIKey JXPIPZIFJMSEQW-YVEASBDZSA-N
Mol Weight 632.7 g/mol
Molecular Formula C37H39F3N2O4
Exact Mass 632.286192 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9mKNtaKQHjd
Name (2-R,3-S,4-S,5-R)-2-N-BENZYLHYDROXYLAMINE-1,6-DIPHENYL-3,4-O-ISOPROPYLIDENE-5-(N-TRIFLUOROACETYL)-BENZYLAMINE-3,4-HEXANDIOL;MAJOR_ISOMER
Compound Number 24
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C37H38F3N2O4
InChI InChI=1S/C37H39F3N2O4/c1-36(2)45-33(34(46-36)32(24-28-17-9-4-10-18-28)42(44)26-30-21-13-6-14-22-30)31(23-27-15-7-3-8-16-27)41(35(43)37(38,39)40)25-29-19-11-5-12-20-29/h3-22,31-34,44H,23-26H2,1-2H3/t31-,32-,33+,34-/m1/s1
InChIKey JXPIPZIFJMSEQW-YVEASBDZSA-N
Literature Reference Author A.DONDONI,D.PERRONE,M.RINALDI
Literature Reference Citation J.ORG.CHEM.,63,9252(1998)
Literature Reference DOI 10.1021/jo980980u
Solvent DMSO-D6
Source File Reference UWMZ26101