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(Methylthiomethyl) Isobutyl Ketone - ? Isomer
SpectraBase Compound ID 3IZDCgr40Zn
InChI InChI=1S/C7H14OS/c1-6(2)4-7(8)5-9-3/h6H,4-5H2,1-3H3
InChIKey KRKNGWHUCVJAHT-UHFFFAOYSA-N
Mol Weight 146.25 g/mol
Molecular Formula C7H14OS
Exact Mass 146.076536 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BMoAFgO1wqw
Name (Methylthiomethyl) Isobutyl Ketone - ? Isomer
Alternate Name(s) 4-Methyl-1-(methylthio)-2-pentanone 4-Methyl-1-(methylthio)pentan-2-one 4-Methyl-1-methylsulfanylpentan-2-one 4-Methyl-1-methylsulfanyl-pentan-2-one
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Formula C7H14OS
InChI InChI=1S/C7H14OS/c1-6(2)4-7(8)5-9-3/h6H,4-5H2,1-3H3
InChIKey KRKNGWHUCVJAHT-UHFFFAOYSA-N
Molecular Weight 146.248 g/mol
SMILES C(=O)(CC(C)C)CSC
SPLASH splash10-0btj-9100000000-b8f009e9b9493c82512a
Source of Spectrum BW-2001-0-28
Wiley ID 811191