John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=40nqMfUla0c SpectraBase Spectrum ID=2VmMOC4lMR1

(accessed ).
ETHYL-(ALPHA'R,2S)-2-(3'-BENZYLOXY-ALPHA'-METHYLBENZYLOXY)-PROPANOATE;DIASTEREOISOMER-A;ETHYL-(ALPHA'S,2S)-DIASTEREOISOMER-B
SpectraBase Compound ID 40nqMfUla0c
InChI InChI=1S/C40H46O8/c1-6-43-39(41)29(4)47-28(3)37-25-36(46-27-32-17-12-9-13-18-32)22-21-33(37)24-38(48-30(5)40(42)44-7-2)34-19-14-20-35(23-34)45-26-31-15-10-8-11-16-31/h8-23,25,28-30,38H,6-7,24,26-27H2,1-5H3
InChIKey PFPYDXGGKWODLE-UHFFFAOYSA-N
Mol Weight 654.8 g/mol
Molecular Formula C40H46O8
Exact Mass 654.319269 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2VmMOC4lMR1
Name ETHYL-(ALPHA'R,2S)-2-(3'-BENZYLOXY-ALPHA'-METHYLBENZYLOXY)-PROPANOATE;DIASTEREOISOMER-A;ETHYL-(ALPHA'S,2S)-DIASTEREOISOMER-B
Compound Number 15
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H46O8
InChI InChI=1S/C40H46O8/c1-6-43-39(41)29(4)47-28(3)37-25-36(46-27-32-17-12-9-13-18-32)22-21-33(37)24-38(48-30(5)40(42)44-7-2)34-19-14-20-35(23-34)45-26-31-15-10-8-11-16-31/h8-23,25,28-30,38H,6-7,24,26-27H2,1-5H3
InChIKey PFPYDXGGKWODLE-UHFFFAOYSA-N
Literature Reference Author R.AGGARWAL,A.A.BIRKBECK,R.G.F.GILES,I.R.GREEN,Y.GRUCHLIK,F.J .OOSTHUIZEN
Literature Reference Citation AUSTR.J.CHEM.,56,489(2003)
Literature Reference DOI 10.1071/CH03027
Molecular Weight 654.800 g/mol
Solvent CDCl3
Source File Reference UWKP3605
SpectraBase Batch ID 2cuvIaAhuG2