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2,6,6-Tris(methylthiomethyl)-2,4-cyclohexadien-1-one
SpectraBase Compound ID 4ovgoBgMQWF
InChI InChI=1S/C12H18OS3/c1-14-7-10-5-4-6-12(8-15-2,9-16-3)11(10)13/h4-6H,7-9H2,1-3H3
InChIKey WLRHQCWADRSCEG-UHFFFAOYSA-N
Mol Weight 274.45 g/mol
Molecular Formula C12H18OS3
Exact Mass 274.051979 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kw4k7TnaLPg
Name 2,6,6-Tris(methylthiomethyl)-2,4-cyclohexadien-1-one
Alternate Name(s) 2,6,6-tris[(methylsulfanyl)methyl]-2,4-cyclohexadien-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18OS3
InChI InChI=1S/C12H18OS3/c1-14-7-10-5-4-6-12(8-15-2,9-16-3)11(10)13/h4-6H,7-9H2,1-3H3
InChIKey WLRHQCWADRSCEG-UHFFFAOYSA-N
Molecular Weight 274.455 g/mol
SMILES C1(C(=CC=CC1(CSC)CSC)CSC)=O
SPLASH splash10-03di-9810000000-b3f1afab14f5377955ed
Source of Spectrum E1-41-443-6
Wiley ID 1551954