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3-PHENYL-(5R)-(PARA-METHYLPHENYL)-(6T)-CARBETHOXYCYCLOHEX-2-ENONE
SpectraBase Compound ID HHoRKTuBekC
InChI InChI=1S/C22H22O3/c1-3-25-22(24)21-19(17-11-9-15(2)10-12-17)13-18(14-20(21)23)16-7-5-4-6-8-16/h4-12,14,19,21H,3,13H2,1-2H3/t19-,21-/m1/s1
InChIKey MEQUMZWBOYZVSD-TZIWHRDSSA-N
Mol Weight 334.42 g/mol
Molecular Formula C22H22O3
Exact Mass 334.156895 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID nL80a6wxqU
Name 3-PHENYL-(5R)-(PARA-METHYLPHENYL)-(6T)-CARBETHOXYCYCLOHEX-2-ENONE
Compound Number 2E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H22O3
InChI InChI=1S/C22H22O3/c1-3-25-22(24)21-19(17-11-9-15(2)10-12-17)13-18(14-20(21)23)16-7-5-4-6-8-16/h4-12,14,19,21H,3,13H2,1-2H3/t19-,21-/m1/s1
InChIKey MEQUMZWBOYZVSD-TZIWHRDSSA-N
Literature Reference Author C.YUVARAJ,K.PANDIARAJAN
Literature Reference Citation MAGN.RES.CHEM.,49,253(2011)
Literature Reference DOI 10.1002/mrc.2724
Molecular Weight 334.415 g/mol
Solvent CDCl3
Source File Reference UWBT12873