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#2D;(1R,2S,3R)-3-[N-PHENYLSULFONYL-N-(3,5-DIMETHYLPHENYL)-AMINO]-2-BORNANYL-N-(ETHOXYCARBONYL)-N-[(4-NITROPHENYLSULFONYL)-OXY]-2-AMINOMETHYL-3,3,3-TRIFLUOROPRO

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#2D;(1R,2S,3R)-3-[N-PHENYLSULFONYL-N-(3,5-DIMETHYLPHENYL)-AMINO]-2-BORNANYL-N-(ETHOXYCARBONYL)-N-[(4-NITROPHENYLSULFONYL)-OXY]-2-AMINOMETHYL-3,3,3-TRIFLUOROPRO
SpectraBase Compound ID L9P9cWSPjFj
InChI InChI=1S/C37H42F3N3O11S2/c1-7-52-34(45)41(54-56(50,51)28-15-13-25(14-16-28)43(46)47)22-30(37(38,39)40)33(44)53-32-31(29-17-18-36(32,6)35(29,4)5)42(26-20-23(2)19-24(3)21-26)55(48,49)27-11-9-8-10-12-27/h8-16,19-21,29-32H,7,17-18,22H2,1-6H3/t29-,30?,31+,32+,36+/m1/s1
InChIKey OKJLIBRNIITWGE-GIZIWDFLSA-N
Mol Weight 825.9 g/mol
Molecular Formula C37H42F3N3O11S2
Exact Mass 825.221286 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9D2gNy6nGWi
Name #2D;(1R,2S,3R)-3-[N-PHENYLSULFONYL-N-(3,5-DIMETHYLPHENYL)-AMINO]-2-BORNANYL-N-(ETHOXYCARBONYL)-N-[(4-NITROPHENYLSULFONYL)-OXY]-2-AMINOMETHYL-3,3,3-TRIFLUOROPRO
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C37H42F3N3O11S2
InChI InChI=1S/C37H42F3N3O11S2/c1-7-52-34(45)41(54-56(50,51)28-15-13-25(14-16-28)43(46)47)22-30(37(38,39)40)33(44)53-32-31(29-17-18-36(32,6)35(29,4)5)42(26-20-23(2)19-24(3)21-26)55(48,49)27-11-9-8-10-12-27/h8-16,19-21,29-32H,7,17-18,22H2,1-6H3/t29-,30?,31+,32+,36+/m1/s1
InChIKey OKJLIBRNIITWGE-GIZIWDFLSA-N
Literature Reference Author D.COLANTONI,S.FIORAVANTI,L.PELLACANI,P.A.TARDELLA
Literature Reference Citation ORG.LETTERS,6,197(2004)
Literature Reference DOI 10.1021/ol0361554
Solvent CDCl3
Source File Reference UWSI34678