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3-(Aminomethyl)bis(ethylenedithio)tetrathiafulvalene
SpectraBase Compound ID 3kD79WLM3nv
InChI InChI=1S/C11H11NS8/c12-3-5-4-15-8-9(16-5)20-11(19-8)10-17-6-7(18-10)14-2-1-13-6/h5H,1-4,12H2
InChIKey RSEYNDXYBXTPFG-UHFFFAOYSA-N
Mol Weight 413.7 g/mol
Molecular Formula C11H11NS8
Exact Mass 412.865719 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IR5iLT7n5k4
Name 3-(Aminomethyl)bis(ethylenedithio)tetrathiafulvalene
Alternate Name(s) (2-{2H,5H,6H-[1,3]dithiolo[4,5-b][1,4]dithiin-2-ylidene}-2H,5H,6H-[1,3]dithiolo[4,5-b][1,4]dithiin-5-yl)methanamine
Comments Less than 3 mono-isotopic peaks
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Formula C11H11NS8
InChI InChI=1S/C11H11NS8/c12-3-5-4-15-8-9(16-5)20-11(19-8)10-17-6-7(18-10)14-2-1-13-6/h5H,1-4,12H2
InChIKey RSEYNDXYBXTPFG-UHFFFAOYSA-N
Molecular Weight 413.696 g/mol
SMILES NCC1SC=2SC(=C3SC=4SCCSC4S3)SC2SC1
SPLASH splash10-004i-9000000000-1810a59de41a3dc50626
Source of Spectrum Y1-45-2814-7
Wiley ID 1621932