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1-(1-METHYLETHYL)-4-METHYL-3-CYClOHEXENYL-3,5-BIS-(3-METHYL-2-BUTENYL)-4-METHOXYBENZOATE
SpectraBase Compound ID 11beK5G4oMN
InChI InChI=1S/C28H40O3/c1-19(2)9-11-23-17-25(18-24(26(23)30-8)12-10-20(3)4)27(29)31-28(21(5)6)15-13-22(7)14-16-28/h9-10,13,17-18,21H,11-12,14-16H2,1-8H3/t28-/m1/s1
InChIKey FTUGJEDDHXBMPK-MUUNZHRXSA-N
Mol Weight 424.6 g/mol
Molecular Formula C28H40O3
Exact Mass 424.297745 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FzHPuq6poy0
Name 1-(1-METHYLETHYL)-4-METHYL-3-CYClOHEXENYL-3,5-BIS-(3-METHYL-2-BUTENYL)-4-METHOXYBENZOATE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H40O3
InChI InChI=1S/C28H40O3/c1-19(2)9-11-23-17-25(18-24(26(23)30-8)12-10-20(3)4)27(29)31-28(21(5)6)15-13-22(7)14-16-28/h9-10,13,17-18,21H,11-12,14-16H2,1-8H3/t28-/m1/s1
InChIKey FTUGJEDDHXBMPK-MUUNZHRXSA-N
Literature Reference Author J.ORJALA,C.A.J.ERDELMEIER,A.D.WRIGHT,T.RALI,O.STICHER
Literature Reference Citation PLANTA.MED.,59,546(1993)
Literature Reference DOI 10.1055/s-2006-959758
Molecular Weight 424.624 g/mol
Solvent CDCl3
Source File Reference UIAP512