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N.beta.-Benzyl-N.alpha.-benzyloxycarbonyl-N.beta.-phenyl-2-trifluoromethyl-asparagine methyl ester
SpectraBase Compound ID IdtlQnLfJ2s
InChI InChI=1S/C27H25F3N2O5/c1-36-24(34)26(27(28,29)30,31-25(35)37-19-21-13-7-3-8-14-21)17-23(33)32(22-15-9-4-10-16-22)18-20-11-5-2-6-12-20/h2-16H,17-19H2,1H3,(H,31,35)
InChIKey IIOVFZRCLZUUSO-UHFFFAOYSA-N
Mol Weight 514.5 g/mol
Molecular Formula C27H25F3N2O5
Exact Mass 514.171556 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IeRWFxm7hgM
Name N.beta.-Benzyl-N.alpha.-benzyloxycarbonyl-N.beta.-phenyl-2-trifluoromethyl-asparagine methyl ester
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Formula C27H25F3N2O5
InChI InChI=1S/C27H25F3N2O5/c1-36-24(34)26(27(28,29)30,31-25(35)37-19-21-13-7-3-8-14-21)17-23(33)32(22-15-9-4-10-16-22)18-20-11-5-2-6-12-20/h2-16H,17-19H2,1H3,(H,31,35)
InChIKey IIOVFZRCLZUUSO-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