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METHYL-(E,3R,4R,5S)-N-TERT.-BUTOXYCARBONYL-ALPHA-(3,4-DIHYDROXY-5-HYDROXYMETHYL-PYRROLIDINE-2-YLIDENE)-GLYCINATE
SpectraBase Compound ID Bp5YeyjxGmf
InChI InChI=1S/C13H22N2O7/c1-13(2,3)22-12(20)15-8(11(19)21-4)7-10(18)9(17)6(5-16)14-7/h6,9-10,14,16-18H,5H2,1-4H3,(H,15,20)/b8-7+/t6-,9+,10+/m0/s1
InChIKey GRFHTMYPQWWWFO-NADCMBCTSA-N
Mol Weight 318.33 g/mol
Molecular Formula C13H22N2O7
Exact Mass 318.142701 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IU1WIiv3gtJ
Name METHYL-(E,3R,4R,5S)-N-TERT.-BUTOXYCARBONYL-ALPHA-(3,4-DIHYDROXY-5-HYDROXYMETHYL-PYRROLIDINE-2-YLIDENE)-GLYCINATE
Compound Number 21
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H22N2O7
InChI InChI=1S/C13H22N2O7/c1-13(2,3)22-12(20)15-8(11(19)21-4)7-10(18)9(17)6(5-16)14-7/h6,9-10,14,16-18H,5H2,1-4H3,(H,15,20)/b8-7+/t6-,9+,10+/m0/s1
InChIKey GRFHTMYPQWWWFO-NADCMBCTSA-N
Literature Reference Author Y.KONDA-YAMADA,K.ASANO,T.SATOU,S.MONMA,M.SAKAYANAGI,N.SATOU, K.TAKEDA,Y.HARIGAYA
Literature Reference Citation CHEM.PHARM.BULL.,53,529(2005)
Literature Reference DOI 10.1248/cpb.53.529
Molecular Weight 318.327 g/mol
Sample ID 54083
Solvent CDCl3