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(S)-6-(3'-HYDROXY-3'-PHENYLPROPYLAMINO)-2,4-DI-(PYRROLIDIN-1-YL)-PYRIMIDINE-(S);MOSHER'S-ESTER;DIASTEREOISOMER-A
SpectraBase Compound ID BZsk4Lh0vsR
InChI InChI=1S/C31H36F3N5O3/c1-41-30(31(32,33)34,24-14-6-3-7-15-24)28(40)42-25(23-12-4-2-5-13-23)16-17-35-26-22-27(38-18-8-9-19-38)37-29(36-26)39-20-10-11-21-39/h2-7,12-15,22,25H,8-11,16-21H2,1H3,(H,35,36,37)/t25-,30?/m1/s1
InChIKey IKOJHDNVXOINSC-GOWJNXQMSA-N
Mol Weight 583.7 g/mol
Molecular Formula C31H36F3N5O3
Exact Mass 583.277025 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LNLPzdzIhGe
Name (S)-6-(3'-HYDROXY-3'-PHENYLPROPYLAMINO)-2,4-DI-(PYRROLIDIN-1-YL)-PYRIMIDINE-(S);MOSHER'S-ESTER;DIASTEREOISOMER-A
Compound Number 1 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H36F3N5O3
InChI InChI=1S/C31H36F3N5O3/c1-41-30(31(32,33)34,24-14-6-3-7-15-24)28(40)42-25(23-12-4-2-5-13-23)16-17-35-26-22-27(38-18-8-9-19-38)37-29(36-26)39-20-10-11-21-39/h2-7,12-15,22,25H,8-11,16-21H2,1H3,(H,35,36,37)/t25-,30?/m1/s1
InChIKey IKOJHDNVXOINSC-GOWJNXQMSA-N
Literature Reference Author L.JOUBRAN,W.R.JACKSON,E.M.CAMPI,A.J.ROBINSON,B.A.WELLS,P.D.G ODFREY,J.K.CALLAWAY,
Literature Reference Citation AUSTR.J.CHEM.,56,597(2003)
Literature Reference DOI 10.1071/CH03010
Molecular Weight 583.654 g/mol
Solvent CDCl3
Source File Reference UWKP3656