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(1-R,2-R)-N,N'-BIS-((-)-MENTHOXYCARBONYL)-1,2-BIS-(4-TRIFLUOROMETHYLPHENYL)-1,2-ETHANEDIAMINE
SpectraBase Compound ID 7Np9vTMI9ya
InChI InChI=1S/C38H50F6N2O4/c1-21(2)29-17-7-23(5)19-31(29)49-35(47)45-33(25-9-13-27(14-10-25)37(39,40)41)34(26-11-15-28(16-12-26)38(42,43)44)46-36(48)50-32-20-24(6)8-18-30(32)22(3)4/h9-16,21-24,29-34H,7-8,17-20H2,1-6H3,(H,45,47)(H,46,48)/t23-,24+,29+,30-,31-,32-,33+,34+/m1/s1
InChIKey JXXUNTHSBHKLFE-RXSBYQOMSA-N
Mol Weight 712.8 g/mol
Molecular Formula C38H50F6N2O4
Exact Mass 712.367477 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AgLS7nmUOUE
Name (1-R,2-R)-N,N'-BIS-((-)-MENTHOXYCARBONYL)-1,2-BIS-(4-TRIFLUOROMETHYLPHENYL)-1,2-ETHANEDIAMINE
Compound Number 19 A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C38H50F6N2O4
InChI InChI=1S/C38H50F6N2O4/c1-21(2)29-17-7-23(5)19-31(29)49-35(47)45-33(25-9-13-27(14-10-25)37(39,40)41)34(26-11-15-28(16-12-26)38(42,43)44)46-36(48)50-32-20-24(6)8-18-30(32)22(3)4/h9-16,21-24,29-34H,7-8,17-20H2,1-6H3,(H,45,47)(H,46,48)/t23-,24+,29+,30-,31-,32-,33+,34+/m1/s1
InChIKey JXXUNTHSBHKLFE-RXSBYQOMSA-N
Literature Reference Author S.E.DENMARK,X.SU,Y.NISHIGAICHI,D.M.COE,K.T.WONG,S.B.D.WINTER ,J.Y.CHOI
Literature Reference Citation J.ORG.CHEM.,64,1958(1999)
Literature Reference DOI 10.1021/jo9820723
Solvent CDCl3
Source File Reference UWSI39752