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N-TERT.-BUTYLOXYCARBONYL-2-METHYLAMINO-PROPIONIC-ACID-[3-(1,3-DIHYDRO-1,3-DIOXO-2H-ISOINDOLE-2-YL)-2,6-DIOXO-PIPERIDINE-1-YL-METHYL]-ESTER
SpectraBase Compound ID 7AXSCxa1Qe
InChI InChI=1S/2C23H27N3O8/c2*1-13(24(5)22(32)34-23(2,3)4)21(31)33-12-25-17(27)11-10-16(20(25)30)26-18(28)14-8-6-7-9-15(14)19(26)29/h2*6-9,13,16H,10-12H2,1-5H3/t2*13-,16?/m10/s1
InChIKey ZMEQJFVLZIYLRI-VDJIURDLSA-N
Mol Weight 946.96 g/mol
Molecular Formula C46H54N6O16
Exact Mass 946.35963 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FqcPLTjPLkF
Name N-TERT.-BUTYLOXYCARBONYL-2-METHYLAMINO-PROPIONIC-ACID-[3-(1,3-DIHYDRO-1,3-DIOXO-2H-ISOINDOLE-2-YL)-2,6-DIOXO-PIPERIDINE-1-YL-METHYL]-ESTER
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C46H54N6O16
InChI InChI=1S/2C23H27N3O8/c2*1-13(24(5)22(32)34-23(2,3)4)21(31)33-12-25-17(27)11-10-16(20(25)30)26-18(28)14-8-6-7-9-15(14)19(26)29/h2*6-9,13,16H,10-12H2,1-5H3/t2*13-,16?/m10/s1
InChIKey ZMEQJFVLZIYLRI-VDJIURDLSA-N
Literature Reference Author S.HESS,M.A.AKERMANN,S.WNENDT,K.ZWINGENBERGER,K.EGER
Literature Reference Citation BIOORG.MED.CHEM.,9,1279(2001)
Literature Reference DOI 10.1016/S0968-0896(00)00342-4
Molecular Weight 946.965 g/mol
Solvent CDCl3
Source File Reference UWMS21902