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(2E,4R)-2-ethylidene-4-methyl-4-(2-methyl-1,3-dioxolan-2-yl)-1-cyclohexanone
SpectraBase Compound ID E6uC0CQntNu
InChI InChI=1S/C13H20O3/c1-4-10-9-12(2,6-5-11(10)14)13(3)15-7-8-16-13/h4H,5-9H2,1-3H3/b10-4+/t12-/m1/s1
InChIKey PUTQTAPYWOEDOC-LHJMJDNXSA-N
Mol Weight 224.3 g/mol
Molecular Formula C13H20O3
Exact Mass 224.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DogI54QNmrN
Name (2E,4R)-2-ethylidene-4-methyl-4-(2-methyl-1,3-dioxolan-2-yl)-1-cyclohexanone
Alternate Name(s) (2E,4R)-2-ethylidene-4-methyl-4-(2-methyl-1,3-dioxolan-2-yl)cyclohexan-1-one (2E,4R)-2-ethylidene-4-methyl-4-(2-methyl-1,3-dioxolan-2-yl)cyclohexanone
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Formula C13H20O3
InChI InChI=1S/C13H20O3/c1-4-10-9-12(2,6-5-11(10)14)13(3)15-7-8-16-13/h4H,5-9H2,1-3H3/b10-4+/t12-/m1/s1
InChIKey PUTQTAPYWOEDOC-LHJMJDNXSA-N
Molecular Weight 224.300 g/mol
SMILES C1([C@]2(C\C(=C/C)C(CC2)=O)C)(OCCO1)C
SPLASH splash10-000i-9000000000-bf3621a8e8f32c8dc02a
Source of Spectrum J-61-4044-18
Wiley ID 1225389