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METHYL-(4S,1'S)-2-[2-[4-(BENZYLOXY)-PHENYL]-1-(TERT.-BUTOXYCARBONYLAMINO)-ETHYL]-4,5-DIHYDROOXAZOLE-4-CARBOXYLATE
SpectraBase Compound ID 3sb1M2l5ttJ
InChI InChI=1S/C25H30N2O6/c1-25(2,3)33-24(29)27-20(22-26-21(16-32-22)23(28)30-4)14-17-10-12-19(13-11-17)31-15-18-8-6-5-7-9-18/h5-13,20-21H,14-16H2,1-4H3,(H,27,29)/t20-,21-/m0/s1
InChIKey ALTDBLHIAJGYCE-SFTDATJTSA-N
Mol Weight 454.52 g/mol
Molecular Formula C25H30N2O6
Exact Mass 454.210387 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6bwUKswGWrU
Name METHYL-(4S,1'S)-2-[2-[4-(BENZYLOXY)-PHENYL]-1-(TERT.-BUTOXYCARBONYLAMINO)-ETHYL]-4,5-DIHYDROOXAZOLE-4-CARBOXYLATE
Compound Number 16L
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H30N2O6
InChI InChI=1S/C25H30N2O6/c1-25(2,3)33-24(29)27-20(22-26-21(16-32-22)23(28)30-4)14-17-10-12-19(13-11-17)31-15-18-8-6-5-7-9-18/h5-13,20-21H,14-16H2,1-4H3,(H,27,29)/t20-,21-/m0/s1
InChIKey ALTDBLHIAJGYCE-SFTDATJTSA-N
Literature Reference Author P.LOOS,C.RONCO,M.RIEDRICH,H.D.ARNDT
Literature Reference Citation EUR.J.ORG.CHEM.,2013,3290(2013)
Literature Reference DOI 10.1002/ejoc.201300160
Molecular Weight 454.523 g/mol
Solvent CDCl3
Source File Reference UWBT20095