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3,5-Dimethyl-2-oxohexan-3-yl acetate
SpectraBase Compound ID Fd9oXjNr54q
InChI InChI=1S/C10H18O3/c1-7(2)6-10(5,8(3)11)13-9(4)12/h7H,6H2,1-5H3
InChIKey JFFJFERIKWIAJF-UHFFFAOYSA-N
Mol Weight 186.25 g/mol
Molecular Formula C10H18O3
Exact Mass 186.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4kdzng6xTdg
Name 3,5-Dimethyl-2-oxohexan-3-yl acetate
Alternate Name(s) Acetic acid (3,5-dimethyl-2-oxohexan-3-yl) ester (3,5-dimethyl-2-oxohexan-3-yl) acetate (1-acetyl-1,3-dimethyl-butyl) acetate (3,5-dimethyl-2-oxidanylidene-hexan-3-yl) ethanoate
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Formula C10H18O3
InChI InChI=1S/C10H18O3/c1-7(2)6-10(5,8(3)11)13-9(4)12/h7H,6H2,1-5H3
InChIKey JFFJFERIKWIAJF-UHFFFAOYSA-N
Literature Reference DOI 10.1021/jo101995g
Molecular Weight 186.251 g/mol
SMILES C(CC(C)C)(C)(C(=O)C)OC(C)=O
SPLASH splash10-002r-0900000000-4a3a31ac444222374768
Source of Spectrum J-76-510-2ad
Wiley ID 1744667