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(2S,6S)-4-OXO-2-PHENYLTETRAHYDROPYRIMIDINE-1,6(2H)-DICARBOXYLIC-ACID-6-ALLYLESTER-1-BENZYLESTER
SpectraBase Compound ID 82BzZxinyWu
InChI InChI=1S/C22H22N2O5/c1-2-13-28-21(26)18-14-19(25)23-20(17-11-7-4-8-12-17)24(18)22(27)29-15-16-9-5-3-6-10-16/h2-12,18,20H,1,13-15H2,(H,23,25)/t18-,20-/m0/s1
InChIKey UBXYOQVXUOCDQT-ICSRJNTNSA-N
Mol Weight 394.43 g/mol
Molecular Formula C22H22N2O5
Exact Mass 394.152872 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ITEdHxjjcah
Name (2S,6S)-4-OXO-2-PHENYLTETRAHYDROPYRIMIDINE-1,6(2H)-DICARBOXYLIC-ACID-6-ALLYLESTER-1-BENZYLESTER
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H22N2O5
InChI InChI=1S/C22H22N2O5/c1-2-13-28-21(26)18-14-19(25)23-20(17-11-7-4-8-12-17)24(18)22(27)29-15-16-9-5-3-6-10-16/h2-12,18,20H,1,13-15H2,(H,23,25)/t18-,20-/m0/s1
InChIKey UBXYOQVXUOCDQT-ICSRJNTNSA-N
Literature Reference Author M.NAHEWOLD,A.STONCIUS,A.PENNER,B.NEUMANN,H.G.STAMMLER,N.SEWA LD
Literature Reference Citation BEIL.J.ORG.CHEM.,5,43,1(2009)
Molecular Weight 394.427 g/mol
Solvent DMSO-D6
Source File Reference UWBT10452