For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

(1S,2S,2''R,3R,5S)-2-(4-ISOBUTYLPHENYL)-PROPIONIC-ACID-5-ISOPROPENYL-2-METHYL-3(NAPHTHALEN-2-YL-SULFANYL)-CYCLOHEX-1-YLESTER;MAJOR-DIASTEREOMER

View entire compound with spectra: 1 NMR

(1S,2S,2''R,3R,5S)-2-(4-ISOBUTYLPHENYL)-PROPIONIC-ACID-5-ISOPROPENYL-2-METHYL-3(NAPHTHALEN-2-YL-SULFANYL)-CYCLOHEX-1-YLESTER;MAJOR-DIASTEREOMER
SpectraBase Compound ID JDUnrWhtNx1
InChI InChI=1S/C33H40O2S/c1-21(2)17-25-11-13-26(14-12-25)23(5)33(34)35-31-19-29(22(3)4)20-32(24(31)6)36-30-16-15-27-9-7-8-10-28(27)18-30/h7-16,18,21,23-24,29,31-32H,3,17,19-20H2,1-2,4-6H3/t23-,24-,29-,31+,32-/m1/s1
InChIKey NQDKHAXFNRIHNP-OEAJFJRISA-N
Mol Weight 500.7 g/mol
Molecular Formula C33H40O2S
Exact Mass 500.274902 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID JB9dJXJUryh
Name (1S,2S,2''R,3R,5S)-2-(4-ISOBUTYLPHENYL)-PROPIONIC-ACID-5-ISOPROPENYL-2-METHYL-3(NAPHTHALEN-2-YL-SULFANYL)-CYCLOHEX-1-YLESTER;MAJOR-DIASTEREOMER
Compound Number 23A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C33H40O2S
InChI InChI=1S/C33H40O2S/c1-21(2)17-25-11-13-26(14-12-25)23(5)33(34)35-31-19-29(22(3)4)20-32(24(31)6)36-30-16-15-27-9-7-8-10-28(27)18-30/h7-16,18,21,23-24,29,31-32H,3,17,19-20H2,1-2,4-6H3/t23-,24-,29-,31+,32-/m1/s1
InChIKey NQDKHAXFNRIHNP-OEAJFJRISA-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 500.739 g/mol
Source File Reference UWBT5921