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(1S,2''S,5S)-2-(4-ISOBUTYLPHENYL)-PROPIONIC-ACID-5-ISOPROPENYL-2-METHYL-3-PARA-TOLYLCYCLOHEX-2-ENYLESTER;MAJOR-DIASTEREOMER

View entire compound with spectra: 1 NMR

(1S,2''S,5S)-2-(4-ISOBUTYLPHENYL)-PROPIONIC-ACID-5-ISOPROPENYL-2-METHYL-3-PARA-TOLYLCYCLOHEX-2-ENYLESTER;MAJOR-DIASTEREOMER
SpectraBase Compound ID CNwYtwUWLPI
InChI InChI=1S/C30H38O2/c1-19(2)16-24-10-14-25(15-11-24)22(6)30(31)32-29-18-27(20(3)4)17-28(23(29)7)26-12-8-21(5)9-13-26/h8-15,19,22,27,29H,3,16-18H2,1-2,4-7H3/t22-,27+,29+/m1/s1
InChIKey VEFJYUXTZPMXLL-RVBRUHEGSA-N
Mol Weight 430.6 g/mol
Molecular Formula C30H38O2
Exact Mass 430.28718 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EGcJzy6ll2X
Name (1S,2''S,5S)-2-(4-ISOBUTYLPHENYL)-PROPIONIC-ACID-5-ISOPROPENYL-2-METHYL-3-PARA-TOLYLCYCLOHEX-2-ENYLESTER;MAJOR-DIASTEREOMER
Compound Number 27A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H38O2
InChI InChI=1S/C30H38O2/c1-19(2)16-24-10-14-25(15-11-24)22(6)30(31)32-29-18-27(20(3)4)17-28(23(29)7)26-12-8-21(5)9-13-26/h8-15,19,22,27,29H,3,16-18H2,1-2,4-7H3/t22-,27+,29+/m1/s1
InChIKey VEFJYUXTZPMXLL-RVBRUHEGSA-N
Literature Reference Author M.AMONGERO,D.VISNOVEZKY,T.S.KAUFMAN
Literature Reference Citation J.BRAZ.CHEM.SOC.,21,1017(2010)
Literature Reference DOI 10.1590/s0103-50532010000600011
Molecular Weight 430.631 g/mol
Source File Reference UWBT5924