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

*Links on SpectraBase are not permalinks.

(2Z,6E,10E)-6,10-DIMETHYL-12-(5-METHYL-3,6-DIOXOCYCLOHEXA-1,4-DIENYL)-2-(4-METHYLPENT-3-ENYL)-DODECA-2,6,10-TRIENOIC-ACID-SARGAQUINOIC-ACID

View entire compound with spectra: 1 NMR

(2Z,6E,10E)-6,10-DIMETHYL-12-(5-METHYL-3,6-DIOXOCYCLOHEXA-1,4-DIENYL)-2-(4-METHYLPENT-3-ENYL)-DODECA-2,6,10-TRIENOIC-ACID-SARGAQUINOIC-ACID
SpectraBase Compound ID 3ZGVcRLnrw7
InChI InChI=1S/C27H36O4/c1-19(2)9-6-13-23(27(30)31)14-8-12-20(3)10-7-11-21(4)15-16-24-18-25(28)17-22(5)26(24)29/h9-10,14-15,17-18H,6-8,11-13,16H2,1-5H3,(H,30,31)/b20-10+,21-15+,23-14-
InChIKey IKUIJYZNRMQNBM-FWXQPYBBSA-N
Mol Weight 424.6 g/mol
Molecular Formula C27H36O4
Exact Mass 424.26136 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 Do41cKR3CKj
Name (2Z,6E,10E)-6,10-DIMETHYL-12-(5-METHYL-3,6-DIOXOCYCLOHEXA-1,4-DIENYL)-2-(4-METHYLPENT-3-ENYL)-DODECA-2,6,10-TRIENOIC-ACID-SARGAQUINOIC-ACID
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H36O4
InChI InChI=1S/C27H36O4/c1-19(2)9-6-13-23(27(30)31)14-8-12-20(3)10-7-11-21(4)15-16-24-18-25(28)17-22(5)26(24)29/h9-10,14-15,17-18H,6-8,11-13,16H2,1-5H3,(H,30,31)/b20-10+,21-15+,23-14-
InChIKey IKUIJYZNRMQNBM-FWXQPYBBSA-N
Literature Reference Author P.REDDY,S.URBAN
Literature Reference Citation PHYTOCHEM.,70,250(2009)
Literature Reference DOI 10.1016/j.phytochem.2008.12.007
Molecular Weight 424.580 g/mol
Sample ID 64504
Solvent CDCl3