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6,6-bis(methylthio)-3,4-dimethylhex-5-en-2-one
SpectraBase Compound ID FSUrUMuTXbl
InChI InChI=1S/C10H18OS2/c1-7(8(2)9(3)11)6-10(12-4)13-5/h6-8H,1-5H3
InChIKey LLOHNFJVLQMPLU-UHFFFAOYSA-N
Mol Weight 218.37 g/mol
Molecular Formula C10H18OS2
Exact Mass 218.079908 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID pm4t0uA9ER
Name 6,6-bis(methylthio)-3,4-dimethylhex-5-en-2-one
CAS Registry Number 119756-10-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H18OS2
InChI InChI=1S/C10H18OS2/c1-7(8(2)9(3)11)6-10(12-4)13-5/h6-8H,1-5H3
InChIKey LLOHNFJVLQMPLU-UHFFFAOYSA-N
Molecular Weight 218.373 g/mol
SMILES C(=C(SC)SC)C(C(C(=O)C)C)C
SPLASH splash10-0002-9500000000-d780f1800624823f7396
Source of Spectrum F-44-3582-22
Synonyms 3,4-Dimethyl-6,6-bis(methylsulfanyl)-5-hexen-2-one
Wiley ID 1217229