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(S-(S),R)-(+)-O,O-DIETHYL-N-(PARA-TOLUENESULFINYL)-1-AMINO-7,7-(ETHYLENEDIOXY)-OCTYLPHOSPHONATE
SpectraBase Compound ID EjoeGnTsBPs
InChI InChI=1S/C21H36NO6PS/c1-5-27-29(23,28-6-2)20(22-30(24)19-13-11-18(3)12-14-19)10-8-7-9-15-21(4)25-16-17-26-21/h11-14,20,22H,5-10,15-17H2,1-4H3/t20-,30?/m1/s1
InChIKey MWXLAGSZCOZSGZ-UEWHNOOISA-N
Mol Weight 461.6 g/mol
Molecular Formula C21H36NO6PS
Exact Mass 461.200096 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1Zj6Y6rbZFL
Name (S-(S),R)-(+)-O,O-DIETHYL-N-(PARA-TOLUENESULFINYL)-1-AMINO-7,7-(ETHYLENEDIOXY)-OCTYLPHOSPHONATE
Compound Number 13D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H36NO6PS
InChI InChI=1S/C21H36NO6PS/c1-5-27-29(23,28-6-2)20(22-30(24)19-13-11-18(3)12-14-19)10-8-7-9-15-21(4)25-16-17-26-21/h11-14,20,22H,5-10,15-17H2,1-4H3/t20-,30?/m1/s1
InChIKey MWXLAGSZCOZSGZ-UEWHNOOISA-N
Literature Reference Author F.A.DAVIS,S.H.LEE,H.XU
Literature Reference Citation J.ORG.CHEM.,69,3774(2004)
Literature Reference DOI 10.1021/jo040127x
Solvent CDCl3
Source File Reference UWVN21383