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2-[(4-METHOXYBENZYL)-(PYRIDINE-3-CARBONYL)-AMINO]-PROPIONIC-ACID-METHYLESTER
SpectraBase Compound ID 5XDC3vOLz85
InChI InChI=1S/2C18H20N2O4/c2*1-13(18(22)24-3)20(17(21)15-5-4-10-19-11-15)12-14-6-8-16(23-2)9-7-14/h2*4-11,13H,12H2,1-3H3
InChIKey RVKHCSIDWYAWMC-UHFFFAOYSA-N
Mol Weight 656.74 g/mol
Molecular Formula C36H40N4O8
Exact Mass 656.284614 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9dzgLTvPDEh
Name 2-[(4-METHOXYBENZYL)-(PYRIDINE-3-CARBONYL)-AMINO]-PROPIONIC-ACID-METHYLESTER
Compound Number 5F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H40N4O8
InChI InChI=1S/2C18H20N2O4/c2*1-13(18(22)24-3)20(17(21)15-5-4-10-19-11-15)12-14-6-8-16(23-2)9-7-14/h2*4-11,13H,12H2,1-3H3
InChIKey RVKHCSIDWYAWMC-UHFFFAOYSA-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 656.736 g/mol
Sample ID 58925
Solvent CDCl3