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2,3-Bis(acetylthiomethyl)tetrathiafulvalene
SpectraBase Compound ID 9xxmn9G155y
InChI InChI=1S/C12H12O2S6/c1-7(13)17-5-9-10(6-18-8(2)14)20-12(19-9)11-15-3-4-16-11/h3-4H,5-6H2,1-2H3
InChIKey GSIFXHBLBYGGOS-UHFFFAOYSA-N
Mol Weight 380.6 g/mol
Molecular Formula C12H12O2S6
Exact Mass 379.916157 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JYvOxMehWoC
Name 2,3-Bis(acetylthiomethyl)tetrathiafulvalene
Alternate Name(s) 1-[({5-[(acetylsulfanyl)methyl]-2-(2H-1,3-dithiol-2-ylidene)-2H-1,3-dithiol-4-yl}methyl)sulfanyl]ethan-1-one 4,5-Bis(acetylthiomethyl)tetrathiafulvalene
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Formula C12H12O2S6
InChI InChI=1S/C12H12O2S6/c1-7(13)17-5-9-10(6-18-8(2)14)20-12(19-9)11-15-3-4-16-11/h3-4H,5-6H2,1-2H3
InChIKey GSIFXHBLBYGGOS-UHFFFAOYSA-N
Molecular Weight 380.586 g/mol
SMILES C1(SC(CSC(=O)C)=C(S1)CSC(=O)C)=C1SC=CS1
SPLASH splash10-001i-3595000000-4fd9851483f7792a314c
Source of Spectrum QE-7-5081-10
Wiley ID 846075