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BENZYL-N-(TERT.-BUTOXYCARBONYL)-BETA-ALANYL-[ALPHA-METHYL-(2R)-GLUTAMYL]-GAMMA-GLYCINATE-ESTER
SpectraBase Compound ID KiWZbobP8gW
InChI InChI=1S/C23H33N3O8/c1-23(2,3)34-22(31)24-13-12-19(28)26-17(21(30)32-4)10-11-18(27)25-14-20(29)33-15-16-8-6-5-7-9-16/h5-9,17H,10-15H2,1-4H3,(H,24,31)(H,25,27)(H,26,28)/t17-/m1/s1
InChIKey QWLNEMSXBZNQLW-QGZVFWFLSA-N
Mol Weight 479.5 g/mol
Molecular Formula C23H33N3O8
Exact Mass 479.226765 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3Op1pEzEbf4
Name BENZYL-N-(TERT.-BUTOXYCARBONYL)-BETA-ALANYL-[ALPHA-METHYL-(2R)-GLUTAMYL]-GAMMA-GLYCINATE-ESTER
Compound Number 1 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H33N3O8
InChI InChI=1S/C23H33N3O8/c1-23(2,3)34-22(31)24-13-12-19(28)26-17(21(30)32-4)10-11-18(27)25-14-20(29)33-15-16-8-6-5-7-9-16/h5-9,17H,10-15H2,1-4H3,(H,24,31)(H,25,27)(H,26,28)/t17-/m1/s1
InChIKey QWLNEMSXBZNQLW-QGZVFWFLSA-N
Literature Reference Author A.P.MEHROTRA,K.L.WEBSTER,D.GANI
Literature Reference Citation J.CHEM.SOC.PERKIN-1,2495(1997)
Literature Reference DOI 10.1039/a702407j
Molecular Weight 479.530 g/mol
Solvent CDCl3
Source File Reference UWCP9204