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6-[3'-HYDROXY-3'-(4''-METHOXYPHENYL)-PROPYLAMINO]-2,4-DI-(PYRROLIDIN-1-YL)-PYRIMIDINE
SpectraBase Compound ID C4EGxSBIJWt
InChI InChI=1S/C22H31N5O2/c1-29-18-8-6-17(7-9-18)19(28)10-11-23-20-16-21(26-12-2-3-13-26)25-22(24-20)27-14-4-5-15-27/h6-9,16,19,28H,2-5,10-15H2,1H3,(H,23,24,25)
InChIKey NVWCOYGFCDBQIA-UHFFFAOYSA-N
Mol Weight 397.52 g/mol
Molecular Formula C22H31N5O2
Exact Mass 397.247775 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JaOUi0riVw6
Name 6-[3'-HYDROXY-3'-(4''-METHOXYPHENYL)-PROPYLAMINO]-2,4-DI-(PYRROLIDIN-1-YL)-PYRIMIDINE
Compound Number 5C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H31N5O2
InChI InChI=1S/C22H31N5O2/c1-29-18-8-6-17(7-9-18)19(28)10-11-23-20-16-21(26-12-2-3-13-26)25-22(24-20)27-14-4-5-15-27/h6-9,16,19,28H,2-5,10-15H2,1H3,(H,23,24,25)
InChIKey NVWCOYGFCDBQIA-UHFFFAOYSA-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 397.520 g/mol
Solvent CDCl3
Source File Reference UWKP3650