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4-(ethylthio)-2-keto-3,3-dimethyl-butyric acid methyl ester
SpectraBase Compound ID 5Iqnd8lQPTF
InChI InChI=1S/C9H16O3S/c1-5-13-6-9(2,3)7(10)8(11)12-4/h5-6H2,1-4H3
InChIKey AZKNGXWLGATROD-UHFFFAOYSA-N
Mol Weight 204.28 g/mol
Molecular Formula C9H16O3S
Exact Mass 204.082016 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 44yhhfOfz6z
Name 4-(ethylthio)-2-keto-3,3-dimethyl-butyric acid methyl ester
Alternate Name(s) 4-(ethylthio)-3,3-dimethyl-2-oxobutanoic acid methyl ester Methyl 4-ethylsulfanyl-3,3-dimethyl-2-oxidanylidene-butanoate Methyl 4-ethylsulfanyl-3,3-dimethyl-2-oxobutanoate
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Formula C9H16O3S
InChI InChI=1S/C9H16O3S/c1-5-13-6-9(2,3)7(10)8(11)12-4/h5-6H2,1-4H3
InChIKey AZKNGXWLGATROD-UHFFFAOYSA-N
Molecular Weight 204.284 g/mol
SMILES C(C(=O)OC)(C(CSCC)(C)C)=O
SPLASH splash10-0a6r-9100000000-109b121ef1f22ebab8ec
Source of Spectrum J-59-6983-27
Wiley ID 1201399