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2-(3-methyl-1-cyclohex-2-enyl)-3-oxobutanoic acid methyl ester
SpectraBase Compound ID 5oZKmS8jsMK
InChI InChI=1S/C12H18O3/c1-8-5-4-6-10(7-8)11(9(2)13)12(14)15-3/h7,10-11H,4-6H2,1-3H3
InChIKey XZWNJBABEAQDJK-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 6hN7lkU4OC8
Name 2-(3-methyl-1-cyclohex-2-enyl)-3-oxobutanoic acid methyl ester
Alternate Name(s) 3-keto-2-(3-methylcyclohex-2-en-1-yl)butyric acid methyl ester methyl 2-(3-methylcyclohex-2-en-1-yl)-3-oxidanylidene-butanoate methyl 2-(3-methylcyclohex-2-en-1-yl)-3-oxo-butanoate
Comments Less than 3 mono-isotopic peaks
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Formula C12H18O3
InChI InChI=1S/C12H18O3/c1-8-5-4-6-10(7-8)11(9(2)13)12(14)15-3/h7,10-11H,4-6H2,1-3H3
InChIKey XZWNJBABEAQDJK-UHFFFAOYSA-N
Molecular Weight 210.273 g/mol
SMILES C(C1C=C(C)CCC1)(C(=O)OC)C(=O)C
SPLASH splash10-0006-0900000000-899997cae505e73fee22
Source of Spectrum J-64-2747-48
Wiley ID 1529837