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2-tert-Butyl-6-methyl-6-(methylsulfanylmethyl)cyclohexa-2,4-dien-1-one
SpectraBase Compound ID Fqr4Mr6CCv8
InChI InChI=1S/C13H20OS/c1-12(2,3)10-7-6-8-13(4,9-15-5)11(10)14/h6-8H,9H2,1-5H3
InChIKey RSXKYTSOMVYVNO-UHFFFAOYSA-N
Mol Weight 224.36 g/mol
Molecular Formula C13H20OS
Exact Mass 224.123486 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G4soImHVpSC
Name 2-tert-Butyl-6-methyl-6-(methylsulfanylmethyl)cyclohexa-2,4-dien-1-one
Alternate Name(s) 2-tert-Butyl-6-methyl-6-[(methylthio)methyl]-1-cyclohexa-2,4-dienone 2-tert-Butyl-6-methyl-6-[(methylthio)methyl]cyclohexa-2,4-dien-1-one
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Formula C13H20OS
InChI InChI=1S/C13H20OS/c1-12(2,3)10-7-6-8-13(4,9-15-5)11(10)14/h6-8H,9H2,1-5H3
InChIKey RSXKYTSOMVYVNO-UHFFFAOYSA-N
Molecular Weight 224.362 g/mol
SMILES C1(C(=CC=CC1(CSC)C)C(C)(C)C)=O
SPLASH splash10-03di-9300000000-1e0626cb0169d9bd9864
Source of Spectrum E1-41-441-3
Wiley ID 1551857