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(E)-ETHYL-3-[(S)-1-(TERT.-BUTOXYCARBONYL)-2-CARBAMOYLETHYL-AMINO]-ACRYLATE;TRANS_ISOMER
SpectraBase Compound ID 4rsPcySj59g
InChI InChI=1S/C13H22N2O5/c1-5-19-11(17)6-7-15-9(8-10(14)16)12(18)20-13(2,3)4/h6-7,9,15H,5,8H2,1-4H3,(H2,14,16)/b7-6+/t9-/m0/s1
InChIKey AWXRZSRXUKDMHB-UCUJLANTSA-N
Mol Weight 286.33 g/mol
Molecular Formula C13H22N2O5
Exact Mass 286.152872 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6ZvLM3trG81
Name (E)-ETHYL-3-[(S)-1-(TERT.-BUTOXYCARBONYL)-2-CARBAMOYLETHYL-AMINO]-ACRYLATE;TRANS_ISOMER
Compound Number 22
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H22N2O5
InChI InChI=1S/C13H22N2O5/c1-5-19-11(17)6-7-15-9(8-10(14)16)12(18)20-13(2,3)4/h6-7,9,15H,5,8H2,1-4H3,(H2,14,16)/b7-6+/t9-/m0/s1
InChIKey AWXRZSRXUKDMHB-UCUJLANTSA-N
Literature Reference Author A.BREUNING,B.DEGEL,F.SCHULZ,C.BUECHOLD,M.STEMPKA,U.MACHON,S. HEPPNER,C.GELHAUS,M.
Literature Reference Citation J.MED.CHEM.,53,1951(2010)
Literature Reference DOI 10.1021/jm900946n
Molecular Weight 286.328 g/mol
Solvent CDCl3
Source File Reference UWMZ46499