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2,2'-(2,3-Dihydrp-2,2-dimethyl-1H-phenalene-1,3-diylidene)bis(1,3-benzodithiole)
SpectraBase Compound ID Li8VN68JIK7
InChI InChI=1S/C29H20S4/c1-29(2)25(27-30-20-13-3-4-14-21(20)31-27)18-11-7-9-17-10-8-12-19(24(17)18)26(29)28-32-22-15-5-6-16-23(22)33-28/h3-16H,1-2H3
InChIKey XJJZUWXEATYGHX-UHFFFAOYSA-N
Mol Weight 496.7 g/mol
Molecular Formula C29H20S4
Exact Mass 496.044785 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IH4Ti10ZiaF
Name 2,2'-(2,3-Dihydrp-2,2-dimethyl-1H-phenalene-1,3-diylidene)bis(1,3-benzodithiole)
Alternate Name(s) 2-[3-(1,3-benzodithiol-2-ylidene)-2,2-dimethyl-1-phenalenylidene]-1,3-benzodithiole 2-[3-(1,3-benzodithiol-2-ylidene)-2,2-dimethylphenalen-1-ylidene]-1,3-benzodithiole
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Formula C29H20S4
InChI InChI=1S/C29H20S4/c1-29(2)25(27-30-20-13-3-4-14-21(20)31-27)18-11-7-9-17-10-8-12-19(24(17)18)26(29)28-32-22-15-5-6-16-23(22)33-28/h3-16H,1-2H3
InChIKey XJJZUWXEATYGHX-UHFFFAOYSA-N
Molecular Weight 496.719 g/mol
SMILES C1(=C2C(C(=C3Sc4ccccc4S3)c3c4c2cccc4ccc3)(C)C)Sc2ccccc2S1
SPLASH splash10-0006-0089300000-99b6c871698f79426ebb
Source of Spectrum KC-0-3419-1
Wiley ID 831764