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(2S,5R)-1-BENZYL-3-TERT.-BUTYL-5-(2-TERT.-BUTOXY-2-OXOETHYL)-4-OXO-2-PHENYL-DIHYDROPYRIMIDINE-1,3(2H,4H)-DICARBOXYLATE
SpectraBase Compound ID 1b0U2xTXVnZ
InChI InChI=1S/2C29H36N2O7/c2*1-28(2,3)37-23(32)17-22-18-30(26(34)36-19-20-13-9-7-10-14-20)24(21-15-11-8-12-16-21)31(25(22)33)27(35)38-29(4,5)6/h2*7-16,22,24H,17-19H2,1-6H3/t2*22-,24+/m11/s1
InChIKey MIUPBIWTMFJKKM-GNGUPYIXSA-N
Mol Weight 1049.2 g/mol
Molecular Formula C58H72N4O14
Exact Mass 1048.504503 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6REns3fwmJj
Name (2S,5R)-1-BENZYL-3-TERT.-BUTYL-5-(2-TERT.-BUTOXY-2-OXOETHYL)-4-OXO-2-PHENYL-DIHYDROPYRIMIDINE-1,3(2H,4H)-DICARBOXYLATE
Compound Number 11D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C58H72N4O14
InChI InChI=1S/2C29H36N2O7/c2*1-28(2,3)37-23(32)17-22-18-30(26(34)36-19-20-13-9-7-10-14-20)24(21-15-11-8-12-16-21)31(25(22)33)27(35)38-29(4,5)6/h2*7-16,22,24H,17-19H2,1-6H3/t2*22-,24+/m11/s1
InChIKey MIUPBIWTMFJKKM-GNGUPYIXSA-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 1049.228 g/mol
Solvent CDCl3
Source File Reference UWBT10457