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Malonic acid, 2-(4-ethylthiophenyl)-2-hydroxy-, diisobutyl ester
SpectraBase Compound ID 9Sau1P0LWW2
InChI InChI=1S/C19H28O5S/c1-6-25-16-9-7-15(8-10-16)19(22,17(20)23-11-13(2)3)18(21)24-12-14(4)5/h7-10,13-14,22H,6,11-12H2,1-5H3
InChIKey XWTWGXRJJQYRFG-UHFFFAOYSA-N
Mol Weight 368.49 g/mol
Molecular Formula C19H28O5S
Exact Mass 368.165745 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B08pbFUmSsy
Name Malonic acid, 2-(4-ethylthiophenyl)-2-hydroxy-, diisobutyl ester
Alternate Name(s) 2-[4-(ethylthio)phenyl]-2-hydroxy-malonic acid diisobutyl ester 2-[4-(ethylthio)phenyl]-2-hydroxypropanedioic acid bis(2-methylpropyl) ester bis(2-methylpropyl) 2-(4-ethylsulfanylphenyl)-2-hydroxypropanedioate bis(2-methylpropyl) 2-(4-ethylsulfanylphenyl)-2-oxidanyl-propanedioate diisobutyl 2-(4-ethylsulfanylphenyl)-2-hydroxy-propanedioate Diisobutyl 2-[4-(ethylsulfanyl)phenyl]-2-hydroxymalonate
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Formula C19H28O5S
InChI InChI=1S/C19H28O5S/c1-6-25-16-9-7-15(8-10-16)19(22,17(20)23-11-13(2)3)18(21)24-12-14(4)5/h7-10,13-14,22H,6,11-12H2,1-5H3
InChIKey XWTWGXRJJQYRFG-UHFFFAOYSA-N
Molecular Weight 368.488 g/mol
SMILES OC(C(OCC(C)C)=O)(C(=O)OCC(C)C)c1ccc(cc1)SCC
SPLASH splash10-014i-6971000000-0791388014b944d2fc4d
Wiley ID 1494760