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(1'S,3S,5S)-3-[1'-[(TERT.-BUTYLOXYCARBONYL)-AMINO]-2'-PHENYLETHYL]-5-ISOBUTYL-2,6-DIOXOPIPERAZINE
SpectraBase Compound ID LIk0zK1cAAI
InChI InChI=1S/C21H31N3O4/c1-13(2)11-16-18(25)24-19(26)17(22-16)15(12-14-9-7-6-8-10-14)23-20(27)28-21(3,4)5/h6-10,13,15-17,22H,11-12H2,1-5H3,(H,23,27)(H,24,25,26)/t15-,16+,17+/m0/s1
InChIKey SWSMVADVYLLLBL-GVDBMIGSSA-N
Mol Weight 389.5 g/mol
Molecular Formula C21H31N3O4
Exact Mass 389.231456 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7vdOVpAePTA
Name (1'S,3S,5S)-3-[1'-[(TERT.-BUTYLOXYCARBONYL)-AMINO]-2'-PHENYLETHYL]-5-ISOBUTYL-2,6-DIOXOPIPERAZINE
Compound Number 7A-S
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H31N3O4
InChI InChI=1S/C21H31N3O4/c1-13(2)11-16-18(25)24-19(26)17(22-16)15(12-14-9-7-6-8-10-14)23-20(27)28-21(3,4)5/h6-10,13,15-17,22H,11-12H2,1-5H3,(H,23,27)(H,24,25,26)/t15-,16+,17+/m0/s1
InChIKey SWSMVADVYLLLBL-GVDBMIGSSA-N
Literature Reference Author M.L.SUAREZ-GEA,M.T.G.LOPEZ,R.HERRANZ
Literature Reference Citation J.ORG.CHEM.,59,3600(1994)
Literature Reference DOI 10.1021/jo00092a019
Molecular Weight 389.495 g/mol
Solvent CDCl3
Source File Reference UWCP7005