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6-methoxylcarbonyl-3,3-dimethyl-4.alpha.,6.alpha.-di(.gamma.,.gamma.-dimethylallyl)-2.alpha.-(2-methyl1-oxo-propyl)cyclohexanone

View entire compound with spectra: 1 MS (GC)

6-methoxylcarbonyl-3,3-dimethyl-4.alpha.,6.alpha.-di(.gamma.,.gamma.-dimethylallyl)-2.alpha.-(2-methyl1-oxo-propyl)cyclohexanone
SpectraBase Compound ID 4Au1Cn3PVT0
InChI InChI=1S/C24H38O4/c1-15(2)10-11-18-14-24(22(27)28-9,13-12-16(3)4)21(26)19(23(18,7)8)20(25)17(5)6/h10,12,17-19H,11,13-14H2,1-9H3/t18-,19+,24-/m1/s1
InChIKey PUEQVSOMWQRMBH-YDIMBITNSA-N
Mol Weight 390.6 g/mol
Molecular Formula C24H38O4
Exact Mass 390.27701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4hDVLrsghuE
Name 6-methoxylcarbonyl-3,3-dimethyl-4.alpha.,6.alpha.-di(.gamma.,.gamma.-dimethylallyl)-2.alpha.-(2-methyl1-oxo-propyl)cyclohexanone
Alternate Name(s) Garcinielliptone O
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H38O4
InChI InChI=1S/C24H38O4/c1-15(2)10-11-18-14-24(22(27)28-9,13-12-16(3)4)21(26)19(23(18,7)8)20(25)17(5)6/h10,12,17-19H,11,13-14H2,1-9H3/t18-,19+,24-/m1/s1
InChIKey PUEQVSOMWQRMBH-YDIMBITNSA-N
Instrument Name JMS-HX100
Ionization Type EI
Literature Reference DOI 10.1021/np049811x
Molecular Weight 390.564 g/mol
Optical Rotation [a]D = -277 (c = 016, CHCl3)
Reported Formula C24H38O4
SMILES [C@@]1(C([C@@](C([C@@](C1)(CC=C(C)C)[H])(C)C)(C(=O)C(C)C)[H])=O)(CC=C(C)C)C(OC)=O
SPLASH splash10-00l7-2039000000-579aca2dfb215724fc1c
Source of Spectrum G4-67-1799-5
Wiley ID 1881592