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7-Methyl-1,1-bis(methylthio)-1,6-octadien-3-one
SpectraBase Compound ID 1FMAGUEtZNJ
InChI InChI=1S/C11H18OS2/c1-9(2)6-5-7-10(12)8-11(13-3)14-4/h6,8H,5,7H2,1-4H3
InChIKey SXOSUMXOMMGJBP-UHFFFAOYSA-N
Mol Weight 230.38 g/mol
Molecular Formula C11H18OS2
Exact Mass 230.079908 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3riE4LB6Jeb
Name 7-Methyl-1,1-bis(methylthio)-1,6-octadien-3-one
Alternate Name(s) 7-Methyl-1,1-bis(methylsulfanyl)-1,6-octadien-3-one
CAS Registry Number 84735-54-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H18OS2
InChI InChI=1S/C11H18OS2/c1-9(2)6-5-7-10(12)8-11(13-3)14-4/h6,8H,5,7H2,1-4H3
InChIKey SXOSUMXOMMGJBP-UHFFFAOYSA-N
Molecular Weight 230.384 g/mol
SMILES C(=C(SC)SC)C(=O)CCC=C(C)C
SPLASH splash10-014j-9570000000-c9919268e2045ac9e3d1
Source of Spectrum J-49-3822-0
Wiley ID 1231430