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2-[(S)-1-(4-METHOXYPHENYL)-ETHYL]-3-OXO-OCTAHYDROPYRROLO-[3,4-C]-PYRIDINE-1,5-DICARBOXYLIC-ACID-1-TERT.-BUTYLESTER-5-METHYLESTER
SpectraBase Compound ID H5e9DYmSKDD
InChI InChI=1S/C23H32N2O6/c1-14(15-7-9-16(29-5)10-8-15)25-19(21(27)31-23(2,3)4)17-11-12-24(22(28)30-6)13-18(17)20(25)26/h7-10,14,17-19H,11-13H2,1-6H3/t14-,17?,18?,19?/m0/s1
InChIKey HGQOSIOQUZNKAK-ZWNCQPIPSA-N
Mol Weight 432.5 g/mol
Molecular Formula C23H32N2O6
Exact Mass 432.226037 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D8JRMlo7TpH
Name 2-[(S)-1-(4-METHOXYPHENYL)-ETHYL]-3-OXO-OCTAHYDROPYRROLO-[3,4-C]-PYRIDINE-1,5-DICARBOXYLIC-ACID-1-TERT.-BUTYLESTER-5-METHYLESTER
Compound Number 25A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H32N2O6
InChI InChI=1S/C23H32N2O6/c1-14(15-7-9-16(29-5)10-8-15)25-19(21(27)31-23(2,3)4)17-11-12-24(22(28)30-6)13-18(17)20(25)26/h7-10,14,17-19H,11-13H2,1-6H3/t14-,17?,18?,19?/m0/s1
InChIKey HGQOSIOQUZNKAK-ZWNCQPIPSA-N
Literature Reference Author G.ARNOTT,J.CLAYDEN,S.D.HAMILTON
Literature Reference Citation ORG.LETTERS,8,5325(2006)
Literature Reference DOI 10.1021/ol062126s
Molecular Weight 432.517 g/mol
Sample ID 58953
Solvent CDCl3