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2-[4-BENZYL-(2S)-[(1S)-[(TERT.-BUTOXYCARBONYL)-AMINO]-2-PHENYLETHYL]-5-OXO-PIPERAZIN-1-YL]-ACETIC-ACID
SpectraBase Compound ID 894yxu8U1rP
InChI InChI=1S/C26H33N3O5/c1-26(2,3)34-25(33)27-21(14-19-10-6-4-7-11-19)22-16-29(15-20-12-8-5-9-13-20)23(30)17-28(22)18-24(31)32/h4-13,21-22H,14-18H2,1-3H3,(H,27,33)(H,31,32)/t21-,22-/m0/s1
InChIKey IVVYJTIJYBVHHT-VXKWHMMOSA-N
Mol Weight 467.6 g/mol
Molecular Formula C26H33N3O5
Exact Mass 467.242021 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EzW2kTIvJNt
Name 2-[4-BENZYL-(2S)-[(1S)-[(TERT.-BUTOXYCARBONYL)-AMINO]-2-PHENYLETHYL]-5-OXO-PIPERAZIN-1-YL]-ACETIC-ACID
Compound Number 14
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H33N3O5
InChI InChI=1S/C26H33N3O5/c1-26(2,3)34-25(33)27-21(14-19-10-6-4-7-11-19)22-16-29(15-20-12-8-5-9-13-20)23(30)17-28(22)18-24(31)32/h4-13,21-22H,14-18H2,1-3H3,(H,27,33)(H,31,32)/t21-,22-/m0/s1
InChIKey IVVYJTIJYBVHHT-VXKWHMMOSA-N
Literature Reference Author A.M.VALDIVIELSO,M.T.GARCIA-LOPEZ,M.GUTIERREZ-RODRIGUEZ,R.HER RANZ
Literature Reference Citation MOLECULES,19,4814(2014)
Literature Reference DOI 10.3390/molecules19044814
Molecular Weight 467.565 g/mol
Solvent DMSO-D6
Source File Reference UWBT14775