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(5-S)-5-(1-ETHOXY-ETHOXYMETHYL)-1-(4,5-METHYLENEDIOXY-2-NITRO-BENZOYL)-PYRROLIDIN-2-ONE
SpectraBase Compound ID L8GlS4gaKfs
InChI InChI=1S/2C17H20N2O8/c2*1-3-24-10(2)25-8-11-4-5-16(20)18(11)17(21)12-6-14-15(27-9-26-14)7-13(12)19(22)23/h2*6-7,10-11H,3-5,8-9H2,1-2H3/t10-,11+;10-,11-/m10/s1
InChIKey AGRSWMJJSVSYOZ-OLVGZEQWSA-N
Mol Weight 760.71 g/mol
Molecular Formula C34H40N4O16
Exact Mass 760.243931 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6KZnsjp4w4k
Name (5-S)-5-(1-ETHOXY-ETHOXYMETHYL)-1-(4,5-METHYLENEDIOXY-2-NITRO-BENZOYL)-PYRROLIDIN-2-ONE
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H40N4O16
InChI InChI=1S/2C17H20N2O8/c2*1-3-24-10(2)25-8-11-4-5-16(20)18(11)17(21)12-6-14-15(27-9-26-14)7-13(12)19(22)23/h2*6-7,10-11H,3-5,8-9H2,1-2H3/t10-,11+;10-,11-/m10/s1
InChIKey AGRSWMJJSVSYOZ-OLVGZEQWSA-N
Literature Reference Author N.LANGLOIS,A.ROJAS-ROUSSEAU,C.GASPARD,G.H.WERNER,F.DARRO,R.K ISS
Literature Reference Citation J.MED.CHEM.,44,3754(2001)
Literature Reference DOI 10.1021/jm010937q
Molecular Weight 760.709 g/mol
Sample ID 45134
Solvent CDCl3