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BENZYL-[(2R)-N-(TERT.-BUTOXYCARBONYL)-ALPHA-METHYLASPARTYL]-BETA-(2S)-PHENYLALANINATE-DIESTER
SpectraBase Compound ID 4pUj5VCwzhi
InChI InChI=1S/C26H32N2O7/c1-26(2,3)35-25(32)28-21(23(30)33-4)16-22(29)27-20(15-18-11-7-5-8-12-18)24(31)34-17-19-13-9-6-10-14-19/h5-14,20-21H,15-17H2,1-4H3,(H,27,29)(H,28,32)/t20-,21+/m0/s1
InChIKey BKRXDPKUDBWUIB-LEWJYISDSA-N
Mol Weight 484.5 g/mol
Molecular Formula C26H32N2O7
Exact Mass 484.220951 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 96iQwULWkFU
Name BENZYL-[(2R)-N-(TERT.-BUTOXYCARBONYL)-ALPHA-METHYLASPARTYL]-BETA-(2S)-PHENYLALANINATE-DIESTER
Compound Number 30
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H32N2O7
InChI InChI=1S/C26H32N2O7/c1-26(2,3)35-25(32)28-21(23(30)33-4)16-22(29)27-20(15-18-11-7-5-8-12-18)24(31)34-17-19-13-9-6-10-14-19/h5-14,20-21H,15-17H2,1-4H3,(H,27,29)(H,28,32)/t20-,21+/m0/s1
InChIKey BKRXDPKUDBWUIB-LEWJYISDSA-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 484.549 g/mol
Solvent CDCl3
Source File Reference UWCP9219