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(2S)-1-[(E)-[[(1S)-1-(METHOXYMETHYL)-2-METHYLPROPYL]-IMINO]-(PHENYL)-METHYL]-2-(PHENYLETHYNYL)-2,3-DIHYDROPYRIDIN-4(1H)-ONE
SpectraBase Compound ID FlSfzU9l4tX
InChI InChI=1S/C26H28N2O2/c1-20(2)25(19-30-3)27-26(22-12-8-5-9-13-22)28-17-16-24(29)18-23(28)15-14-21-10-6-4-7-11-21/h4-13,16-17,20,23,25H,18-19H2,1-3H3/b27-26+/t23-,25+/m1/s1
InChIKey PADWMZYCKDYIDV-MJSYSOQXSA-N
Mol Weight 400.52 g/mol
Molecular Formula C26H28N2O2
Exact Mass 400.215078 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KK4X8sK8rpz
Name (2S)-1-[(E)-[[(1S)-1-(METHOXYMETHYL)-2-METHYLPROPYL]-IMINO]-(PHENYL)-METHYL]-2-(PHENYLETHYNYL)-2,3-DIHYDROPYRIDIN-4(1H)-ONE
Compound Number 6I
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H28N2O2
InChI InChI=1S/C26H28N2O2/c1-20(2)25(19-30-3)27-26(22-12-8-5-9-13-22)28-17-16-24(29)18-23(28)15-14-21-10-6-4-7-11-21/h4-13,16-17,20,23,25H,18-19H2,1-3H3/b27-26+/t23-,25+/m1/s1
InChIKey PADWMZYCKDYIDV-MJSYSOQXSA-N
Literature Reference Author T.FOCKEN,A.B.CHARETTE
Literature Reference Citation ORG.LETTERS,8,2985(2006)
Literature Reference DOI 10.1021/ol0609006
Molecular Weight 400.521 g/mol
Sample ID 58137
Solvent CDCl3