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N-CARBOXYBENZYL-TRANS-4-METHYL-L-PROLINE_ETHYLESTER;MIXTURE_OF_ISOMERS
SpectraBase Compound ID FO49YF3K8bo
InChI InChI=1S/2C16H21NO4/c2*1-3-20-15(18)14-9-12(2)10-17(14)16(19)21-11-13-7-5-4-6-8-13/h2*4-8,12,14H,3,9-11H2,1-2H3/t2*12-,14+/m10/s1
InChIKey UXGOPEIKJUPEBI-GJSFELMDSA-N
Mol Weight 582.69 g/mol
Molecular Formula C32H42N2O8
Exact Mass 582.294116 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4MkwCBWLmPj
Name N-CARBOXYBENZYL-TRANS-4-METHYL-L-PROLINE_ETHYLESTER;MIXTURE_OF_ISOMERS
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H42N2O8
InChI InChI=1S/2C16H21NO4/c2*1-3-20-15(18)14-9-12(2)10-17(14)16(19)21-11-13-7-5-4-6-8-13/h2*4-8,12,14H,3,9-11H2,1-2H3/t2*12-,14+/m10/s1
InChIKey UXGOPEIKJUPEBI-GJSFELMDSA-N
Literature Reference Author A.C.MURPHY,M.I.MITOVA,J.W.BLUNT,M.H.G.MUNRO
Literature Reference Citation J.NAT.PROD.,71,806(2008)
Literature Reference DOI 10.1021/np070673w
Molecular Weight 582.694 g/mol
Sample ID 28258
Solvent CDCl3