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2-Pyrrolidinecarboxamide, 1-[4-[4-(T-butoxycarbonyl)piperazin-1-yl]-1,4-dioxobutyl]-N-(2-benzyloxycarbonyl-1-phenylethyl)-

View entire compound with spectra: 1 NMR

2-Pyrrolidinecarboxamide, 1-[4-[4-(T-butoxycarbonyl)piperazin-1-yl]-1,4-dioxobutyl]-N-(2-benzyloxycarbonyl-1-phenylethyl)-
SpectraBase Compound ID K18m8VVwQif
InChI InChI=1S/C34H44N4O7/c1-34(2,3)45-33(43)37-21-19-36(20-22-37)29(39)16-17-30(40)38-18-10-15-28(38)32(42)35-27(26-13-8-5-9-14-26)23-31(41)44-24-25-11-6-4-7-12-25/h4-9,11-14,27-28H,10,15-24H2,1-3H3,(H,35,42)
InChIKey LSOMDQQTMLLZPG-UHFFFAOYSA-N
Mol Weight 620.7 g/mol
Molecular Formula C34H44N4O7
Exact Mass 620.321 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID wISzAdklZH
Name 2-Pyrrolidinecarboxamide, 1-[4-[4-(T-butoxycarbonyl)piperazin-1-yl]-1,4-dioxobutyl]-N-(2-benzyloxycarbonyl-1-phenylethyl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 620.320999766 u
Formula C34H44N4O7
InChI InChI=1S/C34H44N4O7/c1-34(2,3)45-33(43)37-21-19-36(20-22-37)29(39)16-17-30(40)38-18-10-15-28(38)32(42)35-27(26-13-8-5-9-14-26)23-31(41)44-24-25-11-6-4-7-12-25/h4-9,11-14,27-28H,10,15-24H2,1-3H3,(H,35,42)
InChIKey LSOMDQQTMLLZPG-UHFFFAOYSA-N
Molecular Weight 620.747 g/mol
SMILES C1(N(CCC1)C(CCC(N1CCN(C(OC(C)(C)C)=O)CC1)=O)=O)C(NC(CC(=O)OCC1=CC=CC=C1)C1=CC=CC=C1)=O