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Propanol, 3-(1,3,5-trimethyl-2,6-dioxocyclohexyl)
SpectraBase Compound ID Axs6XnBSTeR
InChI InChI=1S/C12H18O3/c1-8-7-9(2)11(15)12(3,10(8)14)5-4-6-13/h6,8-9H,4-5,7H2,1-3H3
InChIKey HAPUSYPGGAHFSC-UHFFFAOYSA-N
Mol Weight 210.27 g/mol
Molecular Formula C12H18O3
Exact Mass 210.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LZ9bXVREWbj
Name Propanol, 3-(1,3,5-trimethyl-2,6-dioxocyclohexyl)
Alternate Name(s) 3-(1,3,5-trimethyl-2,6-dioxo-cyclohexyl)propanal 3-(2,6-diketo-1,3,5-trimethyl-cyclohexyl)propionaldehyde 3-[1,3,5-trimethyl-2,6-bis(oxidanylidene)cyclohexyl]propanal
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Formula C12H18O3
InChI InChI=1S/C12H18O3/c1-8-7-9(2)11(15)12(3,10(8)14)5-4-6-13/h6,8-9H,4-5,7H2,1-3H3
InChIKey HAPUSYPGGAHFSC-UHFFFAOYSA-N
Molecular Weight 210.273 g/mol
SMILES C1(C(=O)C(C)CC(C)C1=O)(C)CCC=O
SPLASH splash10-05mo-9500000000-d90b9a8bd7d5ba61be19
Wiley ID 1478462