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liguloxide-3-one
SpectraBase Compound ID JeJn6ByxxaZ
InChI InChI=1S/C15H24O2/c1-9-5-6-11-8-15(17-14(11,3)4)10(2)13(16)7-12(9)15/h9-12H,5-8H2,1-4H3/t9-,10?,11?,12?,15-/m1/s1
InChIKey OZKQTOYEQUJGQA-FLMJKPQVSA-N
Mol Weight 236.35 g/mol
Molecular Formula C15H24O2
Exact Mass 236.17763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2DaCGjNVXbT
Name liguloxide-3-one
Alternate Name(s) (1S,2S,6R)-2,6,10,10-tetramethyl-11-oxatricyclo[7.2.1.0(1,5)]dodecan-3-one
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Formula C15H24O2
InChI InChI=1S/C15H24O2/c1-9-5-6-11-8-15(17-14(11,3)4)10(2)13(16)7-12(9)15/h9-12H,5-8H2,1-4H3/t9-,10?,11?,12?,15-/m1/s1
InChIKey OZKQTOYEQUJGQA-FLMJKPQVSA-N
Molecular Weight 236.355 g/mol
SMILES [C@]123OC(C)(C)C(C3)CC[C@](C1CC(C2C)=O)(C)[H]
SPLASH splash10-053u-9420000000-92ae2d15c4446df9d7a6
Source of Spectrum LQ-1992-2813-0
Wiley ID 1238671