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Methyl 3-methyl-4-oxooctanoate
SpectraBase Compound ID KPwJC1M5K4y
InChI InChI=1S/C10H18O3/c1-4-5-6-9(11)8(2)7-10(12)13-3/h8H,4-7H2,1-3H3
InChIKey LMFZFRDAXXBECB-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 3crgHvg3zcN
Name Methyl 3-methyl-4-oxooctanoate
Alternate Name(s) 3-Methyl-4-oxooctanoic acid methyl ester 4-keto-3-methyl-caprylic acid methyl ester Methyl 3-methyl-4-oxidanylidene-octanoate
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Formula C10H18O3
InChI InChI=1S/C10H18O3/c1-4-5-6-9(11)8(2)7-10(12)13-3/h8H,4-7H2,1-3H3
InChIKey LMFZFRDAXXBECB-UHFFFAOYSA-N
Molecular Weight 186.251 g/mol
SMILES C(CC(C(=O)CCCC)C)(=O)OC
SPLASH splash10-0a4r-9300000000-fbb8c6f8ffd38cb369fc
Source of Spectrum QE-6-1934-12
Wiley ID 844791