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(R,S)-METHYL-3-ACETOXY-7-OXO-OCTANOATE
SpectraBase Compound ID 1SAdAbIAQz7
InChI InChI=1S/C11H18O5/c1-8(12)5-4-6-10(16-9(2)13)7-11(14)15-3/h10H,4-7H2,1-3H3
InChIKey GAPFKRXOHKZNJY-UHFFFAOYSA-N
Mol Weight 230.26 g/mol
Molecular Formula C11H18O5
Exact Mass 230.115424 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IBnktlsCFOb
Name Methyl 3-acetoxy-7-oxo-octanoate
Alternate Name(s) 3-Acetoxy-7-keto-caprylic acid methyl ester 3-Acetyloxy-7-oxooctanoic acid methyl ester Methyl 3-acetyloxy-7-oxidanylidene-octanoate
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Formula C11H18O5
InChI InChI=1S/C11H18O5/c1-8(12)5-4-6-10(16-9(2)13)7-11(14)15-3/h10H,4-7H2,1-3H3
InChIKey GAPFKRXOHKZNJY-UHFFFAOYSA-N
Molecular Weight 230.260 g/mol
SMILES C(CC(CCCC(C)=O)OC(=O)C)(=O)OC
SPLASH splash10-0aba-9200000000-5fe70f327674ee8f930c
Source of Spectrum G4-62-38-10
Wiley ID 1607652