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Ethyl 4-(1,3,3-Trimethyl-2-methylenecyclohexyl)-3-oxobutanoate
SpectraBase Compound ID Hetp9VbSi1
InChI InChI=1S/C16H26O3/c1-6-19-14(18)10-13(17)11-16(5)9-7-8-15(3,4)12(16)2/h2,6-11H2,1,3-5H3/t16-/m1/s1
InChIKey QBUOYYFITAQSCG-MRXNPFEDSA-N
Mol Weight 266.38 g/mol
Molecular Formula C16H26O3
Exact Mass 266.188195 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ku1NFlp8hIP
Name Ethyl 4-(1,3,3-Trimethyl-2-methylenecyclohexyl)-3-oxobutanoate
Comments Less than 3 mono-isotopic peaks
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Formula C16H26O3
InChI InChI=1S/C16H26O3/c1-6-19-14(18)10-13(17)11-16(5)9-7-8-15(3,4)12(16)2/h2,6-11H2,1,3-5H3/t16-/m1/s1
InChIKey QBUOYYFITAQSCG-MRXNPFEDSA-N
Molecular Weight 266.381 g/mol
SMILES C1([C@@](CC(CC(=O)OCC)=O)(CCCC1(C)C)C)=C
SPLASH splash10-000i-0910000000-4133b5d0ed4cda22a687
Source of Spectrum J-58-7754-8
Synonyms 3-Oxo-4-((R)-1,3,3-trimethyl-2-methylene-cyclohexyl)-butyric acid ethyl ester ethyl 3-oxo-4-(1,3,3-trimethyl-2-methylenecyclohexyl)butanoate
Wiley ID 1270407