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(S,E)-ETHYL_5-(2-BENZYLOXYCARBONYLAMINO-3-PHENYLPROPIONYLOXY)-PENT-2-ENOATE
SpectraBase Compound ID 9Yag8HWFlff
InChI InChI=1S/C24H27NO6/c1-2-29-22(26)15-9-10-16-30-23(27)21(17-19-11-5-3-6-12-19)25-24(28)31-18-20-13-7-4-8-14-20/h3-9,11-15,21H,2,10,16-18H2,1H3,(H,25,28)/b15-9+/t21-/m0/s1
InChIKey RSDGGFCUZASAMY-NMQRCDEWSA-N
Mol Weight 425.48 g/mol
Molecular Formula C24H27NO6
Exact Mass 425.183838 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K3JAdVWDSAx
Name (S,E)-ETHYL_5-(2-BENZYLOXYCARBONYLAMINO-3-PHENYLPROPIONYLOXY)-PENT-2-ENOATE
Compound Number 33
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H27NO6
InChI InChI=1S/C24H27NO6/c1-2-29-22(26)15-9-10-16-30-23(27)21(17-19-11-5-3-6-12-19)25-24(28)31-18-20-13-7-4-8-14-20/h3-9,11-15,21H,2,10,16-18H2,1H3,(H,25,28)/b15-9+/t21-/m0/s1
InChIKey RSDGGFCUZASAMY-NMQRCDEWSA-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 425.481 g/mol
Solvent CDCl3
Source File Reference UWMZ46512