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2,3,6-tris[Methylthio]-7-{]2'-(2"-phthalimidoethoxy)ethoxy]ethylthio}tetrathiafulvalene
SpectraBase Compound ID 4wviwMbjTxH
InChI InChI=1S/C23H25NO4S8/c1-29-18-19(30-2)34-22(33-18)23-35-20(31-3)21(36-23)32-13-12-28-11-10-27-9-8-24-16(25)14-6-4-5-7-15(14)17(24)26/h4-7H,8-13H2,1-3H3
InChIKey ATLAUJAHTLKJAW-UHFFFAOYSA-N
Mol Weight 635.9 g/mol
Molecular Formula C23H25NO4S8
Exact Mass 634.954928 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H2Ikes2rx9D
Name 2,3,6-tris[Methylthio]-7-{]2'-(2"-phthalimidoethoxy)ethoxy]ethylthio}tetrathiafulvalene
Alternate Name(s) 2-[2-[2-[2-[[2-[4,5-bis(methylthio)-1,3-dithiol-2-ylidene]-5-(methylthio)-1,3-dithiol-4-yl]thio]ethoxy]ethoxy]ethyl]isoindole-1,3-dione 2-[2-[2-[2-[[2-[4,5-bis(methylsulfanyl)-1,3-dithiol-2-ylidene]-5-methylsulfanyl-1,3-dithiol-4-yl]sulfanyl]ethoxy]ethoxy]ethyl]isoindoline-1,3-dione 2-[2-[2-[2-[[2-[4,5-bis(methylsulfanyl)-1,3-dithiol-2-ylidene]-5-methylsulfanyl-1,3-dithiol-4-yl]sulfanyl]ethoxy]ethoxy]ethyl]isoindole-1,3-dione
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Formula C23H25NO4S8
InChI InChI=1S/C23H25NO4S8/c1-29-18-19(30-2)34-22(33-18)23-35-20(31-3)21(36-23)32-13-12-28-11-10-27-9-8-24-16(25)14-6-4-5-7-15(14)17(24)26/h4-7H,8-13H2,1-3H3
InChIKey ATLAUJAHTLKJAW-UHFFFAOYSA-N
Molecular Weight 635.936 g/mol
SMILES C1(N(C(c2ccccc12)=O)CCOCCOCCSC=1SC(=C2SC(SC)=C(S2)SC)SC1SC)=O
SPLASH splash10-000i-0211009000-5c3e77e1ea6b6aff157d
Source of Spectrum K1-2000-2142-9
Wiley ID 750383