John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=IBTRqOh9KHJ SpectraBase Spectrum ID=2VrqLPxiKFi

(accessed ).
(Z,TRANS)-ETHYL-4-[4-[(2-HYDROXYCYCLOHEXYL)-METHYL]-PHENOXY]-3-METHYLBUT-2-ENOATE
SpectraBase Compound ID IBTRqOh9KHJ
InChI InChI=1S/C20H28O4/c1-3-23-20(22)12-15(2)14-24-18-10-8-16(9-11-18)13-17-6-4-5-7-19(17)21/h8-12,17,19,21H,3-7,13-14H2,1-2H3/b15-12-/t17-,19+/m1/s1
InChIKey IXHIMBPFWQOBGZ-MEIBIQBFSA-N
Mol Weight 332.44 g/mol
Molecular Formula C20H28O4
Exact Mass 332.19876 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2VrqLPxiKFi
Name (Z,TRANS)-ETHYL-4-[4-[(2-HYDROXYCYCLOHEXYL)-METHYL]-PHENOXY]-3-METHYLBUT-2-ENOATE
Compound Number 4
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H28O4
InChI InChI=1S/C20H28O4/c1-3-23-20(22)12-15(2)14-24-18-10-8-16(9-11-18)13-17-6-4-5-7-19(17)21/h8-12,17,19,21H,3-7,13-14H2,1-2H3/b15-12-/t17-,19+/m1/s1
InChIKey IXHIMBPFWQOBGZ-MEIBIQBFSA-N
Literature Reference Author O.JURCEK,Z.WIMMER,B.BENNETTOVA,J.MORAVCOVA,P.DRASAR,D.SAMAN
Literature Reference Citation J.AGR.FOOD.CHEM.,57,10852(2009)
Literature Reference DOI 10.1021/jf902290s
Molecular Weight 332.440 g/mol
Sample ID 68241
Solvent CDCl3
SpectraBase Batch ID BhT7OPzd7MY