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4-ETHYL-1-METHYL-(3Z)-3-BENZYLIDENE-2-HYDROXY-2-PHENYLSUCCINATE
SpectraBase Compound ID LmtAVfWMfIv
InChI InChI=1S/2C20H20O5/c2*1-3-25-18(21)17(14-15-10-6-4-7-11-15)20(23,19(22)24-2)16-12-8-5-9-13-16/h2*4-14,23H,3H2,1-2H3/b2*17-14+
InChIKey CFIWRTMWPHCMKW-UHLLBEOMSA-N
Mol Weight 680.75 g/mol
Molecular Formula C40H40O10
Exact Mass 680.262147 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KuoFY7DJC86
Name 4-ETHYL-1-METHYL-(3Z)-3-BENZYLIDENE-2-HYDROXY-2-PHENYLSUCCINATE
Compound Number 7O
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H40O10
InChI InChI=1S/2C20H20O5/c2*1-3-25-18(21)17(14-15-10-6-4-7-11-15)20(23,19(22)24-2)16-12-8-5-9-13-16/h2*4-14,23H,3H2,1-2H3/b2*17-14+
InChIKey CFIWRTMWPHCMKW-UHLLBEOMSA-N
Literature Reference Author M.K.W.CHOI,H.S.HE,P.H.TOY
Literature Reference Citation J.ORG.CHEM.,68,9831(2003)
Literature Reference DOI 10.1021/jo035226+
Molecular Weight 680.752 g/mol
Solvent CDCl3
Source File Reference UWLU24418