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METHYL-(E/Z)-5-((TERT.-BUTOXYCARBONYL)-AMINO)-2-CYANO-3-METHYL-2-PENTENOATE
SpectraBase Compound ID 3B3BfovbHg4
InChI InChI=1S/2C13H20N2O4/c2*1-9(10(8-14)11(16)18-5)6-7-15-12(17)19-13(2,3)4/h2*6-7H2,1-5H3,(H,15,17)/b2*10-9+
InChIKey BNIFKZJQXCOGRV-FJEDDJBMSA-N
Mol Weight 536.63 g/mol
Molecular Formula C26H40N4O8
Exact Mass 536.284614 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ihak3yIY44Z
Name METHYL-(E/Z)-5-((TERT.-BUTOXYCARBONYL)-AMINO)-2-CYANO-3-METHYL-2-PENTENOATE
Compound Number 8B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H40N4O8
InChI InChI=1S/2C13H20N2O4/c2*1-9(10(8-14)11(16)18-5)6-7-15-12(17)19-13(2,3)4/h2*6-7H2,1-5H3,(H,15,17)/b2*10-9+
InChIKey BNIFKZJQXCOGRV-FJEDDJBMSA-N
Literature Reference Author H.P.BUCHSTALLER,C.D.SIEBERT,R.H.LYSSY,I.FRANK,A.DURAN,R.GOTT SCHLICH,C.R.NOE
Literature Reference Citation MH.CHEM.,132,279(2001)
Literature Reference DOI 10.1007/s007060170137
Molecular Weight 536.626 g/mol
Solvent CDCl3
Source File Reference UWSI3728