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N-(BENZYLOXYCARBONYL)-BETA-ALANYLPHENYLALANYLPHENYLALANINE
SpectraBase Compound ID ItWzk8ZKzZf
InChI InChI=1S/C29H31N3O6/c33-26(16-17-30-29(37)38-20-23-14-8-3-9-15-23)31-24(18-21-10-4-1-5-11-21)27(34)32-25(28(35)36)19-22-12-6-2-7-13-22/h1-15,24-25H,16-20H2,(H,30,37)(H,31,33)(H,32,34)(H,35,36)/t24-,25-/m0/s1
InChIKey VWPVRTGFJIYZFG-DQEYMECFSA-N
Mol Weight 517.58 g/mol
Molecular Formula C29H31N3O6
Exact Mass 517.221286 g/mol

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4L9IknUVGQ0
Name N-(BENZYLOXYCARBONYL)-BETA-ALANYLPHENYLALANYLPHENYLALANINE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H31N3O6
InChI InChI=1S/C29H31N3O6/c33-26(16-17-30-29(37)38-20-23-14-8-3-9-15-23)31-24(18-21-10-4-1-5-11-21)27(34)32-25(28(35)36)19-22-12-6-2-7-13-22/h1-15,24-25H,16-20H2,(H,30,37)(H,31,33)(H,32,34)(H,35,36)/t24-,25-/m0/s1
InChIKey VWPVRTGFJIYZFG-DQEYMECFSA-N
Literature Reference Author H.R.KRICHELDORF
Literature Reference Citation ORG.MAGN.RES.,15,162(1981)
Literature Reference DOI 10.1002/mrc.1270150211
Solvent DMSO
Source File Reference UWCS17535