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N-(Benzyloxycarbonyl)-alanine (1,3,5-tri-tert-butyl-6-oxo-2,4-cyclohexadien-1-yl) ester

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N-(Benzyloxycarbonyl)-alanine (1,3,5-tri-tert-butyl-6-oxo-2,4-cyclohexadien-1-yl) ester
SpectraBase Compound ID 3OrvDOIKWQA
InChI InChI=1S/C29H41NO5/c1-19(30-25(33)34-18-20-14-12-11-13-15-20)24(32)35-29(28(8,9)10)17-21(26(2,3)4)16-22(23(29)31)27(5,6)7/h11-17,19H,18H2,1-10H3,(H,30,33)
InChIKey QJVAURVGGVQUAE-UHFFFAOYSA-N
Mol Weight 483.6 g/mol
Molecular Formula C29H41NO5
Exact Mass 483.298473 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6XDkQTxBMZi
Name N-(Benzyloxycarbonyl)-alanine (1,3,5-tri-tert-butyl-6-oxo-2,4-cyclohexadien-1-yl) ester
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Formula C29H41NO5
InChI InChI=1S/C29H41NO5/c1-19(30-25(33)34-18-20-14-12-11-13-15-20)24(32)35-29(28(8,9)10)17-21(26(2,3)4)16-22(23(29)31)27(5,6)7/h11-17,19H,18H2,1-10H3,(H,30,33)
InChIKey QJVAURVGGVQUAE-UHFFFAOYSA-N
Literature Reference A. Rieker, R. Beisswenger, K. Regier, Tetrahedron 47, 645 (1991).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3