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3-(4-[N(ALPHA)-TERT.-BUTOXYCARBONYL-L-LEUCINOYLAMINO]-PHENYL)-PROPANOIC-ACID
SpectraBase Compound ID DXVbPV7Qw4r
InChI InChI=1S/C20H30N2O5/c1-13(2)12-16(22-19(26)27-20(3,4)5)18(25)21-15-9-6-14(7-10-15)8-11-17(23)24/h6-7,9-10,13,16H,8,11-12H2,1-5H3,(H,21,25)(H,22,26)(H,23,24)/t16-/m0/s1
InChIKey POENTGADFNBGAW-INIZCTEOSA-N
Mol Weight 378.47 g/mol
Molecular Formula C20H30N2O5
Exact Mass 378.215472 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID hQ1t3tTZy5
Name 3-(4-[N(ALPHA)-TERT.-BUTOXYCARBONYL-L-LEUCINOYLAMINO]-PHENYL)-PROPANOIC-ACID
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H30N2O5
InChI InChI=1S/C20H30N2O5/c1-13(2)12-16(22-19(26)27-20(3,4)5)18(25)21-15-9-6-14(7-10-15)8-11-17(23)24/h6-7,9-10,13,16H,8,11-12H2,1-5H3,(H,21,25)(H,22,26)(H,23,24)/t16-/m0/s1
InChIKey POENTGADFNBGAW-INIZCTEOSA-N
Literature Reference Author C.M.JAKOBSEN,S.R.DENMEADE,J.T.ISAACS,A.GADY,C.E.OLSEN,S.B.CH RISTENSEN
Literature Reference Citation J.MED.CHEM.,44,4696(2001)
Literature Reference DOI 10.1021/jm010985a
Molecular Weight 378.469 g/mol
Sample ID 45245
Solvent CDCl3