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2-(1'-Methoxycarbonyl-3'-methylbutyl)cycloundecanone
SpectraBase Compound ID Jpr0yQfaohj
InChI InChI=1S/C18H32O3/c1-14(2)13-16(18(20)21-3)15-11-9-7-5-4-6-8-10-12-17(15)19/h14-16H,4-13H2,1-3H3
InChIKey HISVTNVXUVEQIU-UHFFFAOYSA-N
Mol Weight 296.5 g/mol
Molecular Formula C18H32O3
Exact Mass 296.235145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9KlYqVGsBQx
Name 2-(1'-Methoxycarbonyl-3'-methylbutyl)cycloundecanone
Alternate Name(s) Methyl 4-methyl-2-(2-oxocycloundecyl)pentanoate
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Formula C18H32O3
InChI InChI=1S/C18H32O3/c1-14(2)13-16(18(20)21-3)15-11-9-7-5-4-6-8-10-12-17(15)19/h14-16H,4-13H2,1-3H3
InChIKey HISVTNVXUVEQIU-UHFFFAOYSA-N
Molecular Weight 296.451 g/mol
SMILES C(C1C(=O)CCCCCCCCC1)(C(=O)OC)CC(C)C
SPLASH splash10-014i-0960000000-7d31d90bb3cc08f7bd03
Source of Spectrum F-48-4786-16
Wiley ID 1299422