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

*Links on SpectraBase are not permalinks.

2,4-DIMETHYL-WEDDELLIANONE-B;(MESO)-4-BENZOYL-3,5-DIMETHOXY-2-(3-METHYLBUT-2-ENYL)-6,6-BIS-[5-METHYL-2-(1-METHYLVINYL)-HEXA-4-ENYL]-CYCLOHEXA-2,4-

View entire compound with spectra: 1 NMR

2,4-DIMETHYL-WEDDELLIANONE-B;(MESO)-4-BENZOYL-3,5-DIMETHOXY-2-(3-METHYLBUT-2-ENYL)-6,6-BIS-[5-METHYL-2-(1-METHYLVINYL)-HEXA-4-ENYL]-CYCLOHEXA-2,4-
SpectraBase Compound ID AhollXkS3O8
InChI InChI=1S/C40H54O4/c1-26(2)18-21-32(29(7)8)24-40(25-33(30(9)10)22-19-27(3)4)38(42)34(23-20-28(5)6)37(43-11)35(39(40)44-12)36(41)31-16-14-13-15-17-31/h13-20,32-33H,7,9,21-25H2,1-6,8,10-12H3
InChIKey ZUCNDVHTSGBZSI-UHFFFAOYSA-N
Mol Weight 598.9 g/mol
Molecular Formula C40H54O4
Exact Mass 598.40221 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 8fpjCRhM4yl
Name 2,4-DIMETHYL-WEDDELLIANONE-B;(MESO)-4-BENZOYL-3,5-DIMETHOXY-2-(3-METHYLBUT-2-ENYL)-6,6-BIS-[5-METHYL-2-(1-METHYLVINYL)-HEXA-4-ENYL]-CYCLOHEXA-2,4-
Compound Number 4A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H54O4
InChI InChI=1S/C40H54O4/c1-26(2)18-21-32(29(7)8)24-40(25-33(30(9)10)22-19-27(3)4)38(42)34(23-20-28(5)6)37(43-11)35(39(40)44-12)36(41)31-16-14-13-15-17-31/h13-20,32-33H,7,9,21-25H2,1-6,8,10-12H3
InChIKey ZUCNDVHTSGBZSI-UHFFFAOYSA-N
Literature Reference Author A.L.M.PORTO,S.M.F.MACHADO,C.M.A.D.OLIVEIRA,V.BITTRICH,M.D.C. E.AMARAL,A.J.MARSAIO
Literature Reference Citation PHYTOCHEM.,55,755(2000)
Literature Reference DOI 10.1016/S0031-9422(00)00292-2
Molecular Weight 598.866 g/mol
Solvent CDCl3
Source File Reference UWLU2599