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Hexanoic acid, 5-methylene-6-(5-methoxycarbonyl-1-cyclohexenyl)-, methyl ester
SpectraBase Compound ID DA8z2dtkCXo
InChI InChI=1S/C16H24O4/c1-12(6-4-9-15(17)19-2)10-13-7-5-8-14(11-13)16(18)20-3/h7,14H,1,4-6,8-11H2,2-3H3
InChIKey NKDCUPQTOCMSKX-UHFFFAOYSA-N
Mol Weight 280.36 g/mol
Molecular Formula C16H24O4
Exact Mass 280.167459 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EXFnnSeQV1y
Name Hexanoic acid, 5-methylene-6-(5-methoxycarbonyl-1-cyclohexenyl)-, methyl ester
Alternate Name(s) 3-(6-Methoxy-2-methylene-6-oxohexyl)-1-cyclohex-3-enecarboxylic acid methyl ester 3-[2-(4-keto-4-methoxy-butyl)allyl]cyclohex-3-ene-1-carboxylic acid methyl ester Methyl 3-(6-methoxy-2-methylene-6-oxo-hexyl)cyclohex-3-ene-1-carboxylate Methyl 3-(6-methoxy-2-methylidene-6-oxidanylidene-hexyl)cyclohex-3-ene-1-carboxylate Methyl 3-(6-methoxy-2-methylidene-6-oxohexyl)cyclohex-3-ene-1-carboxylate Methyl 3-[2-(4-methoxy-4-oxobutyl)-2-propenyl]-3-cyclohexene-1-carboxylate
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Formula C16H24O4
InChI InChI=1S/C16H24O4/c1-12(6-4-9-15(17)19-2)10-13-7-5-8-14(11-13)16(18)20-3/h7,14H,1,4-6,8-11H2,2-3H3
InChIKey NKDCUPQTOCMSKX-UHFFFAOYSA-N
Molecular Weight 280.364 g/mol
SMILES C1CC(C(OC)=O)CC(=C1)CC(=C)CCCC(=O)OC
SPLASH splash10-054o-9600000000-5d3ceb032827f5882a32
Wiley ID 1498481