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N-Benzyloxycarbonyl-2-trifluoromethyl.beta.-aspartyl-(.alpha.-methyl ester)-S-phenyl-alanine methyl ester

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N-Benzyloxycarbonyl-2-trifluoromethyl.beta.-aspartyl-(.alpha.-methyl ester)-S-phenyl-alanine methyl ester
SpectraBase Compound ID EkiZNenZNpi
InChI InChI=1S/C24H25F3N2O7/c1-34-20(31)18(13-16-9-5-3-6-10-16)28-19(30)14-23(21(32)35-2,24(25,26)27)29-22(33)36-15-17-11-7-4-8-12-17/h3-12,18H,13-15H2,1-2H3,(H,28,30)(H,29,33)
InChIKey LHGKHZSRXKIENL-UHFFFAOYSA-N
Mol Weight 510.47 g/mol
Molecular Formula C24H25F3N2O7
Exact Mass 510.161386 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Izvs1JSzxVN
Name N-Benzyloxycarbonyl-2-trifluoromethyl.beta.-aspartyl-(.alpha.-methyl ester)-S-phenyl-alanine methyl ester
Comments DIASTEREOMER 2
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C24H25F3N2O7
InChI InChI=1S/C24H25F3N2O7/c1-34-20(31)18(13-16-9-5-3-6-10-16)28-19(30)14-23(21(32)35-2,24(25,26)27)29-22(33)36-15-17-11-7-4-8-12-17/h3-12,18H,13-15H2,1-2H3,(H,28,30)(H,29,33)
InChIKey LHGKHZSRXKIENL-UHFFFAOYSA-N
Instrument Name Bruker AM-360
Literature Reference N. Sewald, J. Riede, P. Bissinger, J. Chem. Soc. Perkin I 267 (1992).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3