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4,5-Bis(p-acetoxybenzylsulfanyl)-4',5'-bis(methylsulfanyl)tetrathiafulvalene

View entire compound with spectra: 1 MS (GC)

4,5-Bis(p-acetoxybenzylsulfanyl)-4',5'-bis(methylsulfanyl)tetrathiafulvalene
SpectraBase Compound ID 83MJQYkFjB9
InChI InChI=1S/C26H24O4S8/c1-15(27)29-19-9-5-17(6-10-19)13-33-23-24(34-14-18-7-11-20(12-8-18)30-16(2)28)38-26(37-23)25-35-21(31-3)22(32-4)36-25/h5-12H,13-14H2,1-4H3
InChIKey AOIPPSVHFNAGKJ-UHFFFAOYSA-N
Mol Weight 657.0 g/mol
Molecular Formula C26H24O4S8
Exact Mass 655.944029 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KBjhSF9FZcs
Name 4,5-Bis(p-acetoxybenzylsulfanyl)-4',5'-bis(methylsulfanyl)tetrathiafulvalene
Alternate Name(s) 4-({[5-({[4-(acetyloxy)phenyl]methyl}sulfanyl)-2-[4,5-bis(methylsulfanyl)-2H-1,3-dithiol-2-ylidene]-2H-1,3-dithiol-4-yl]sulfanyl}methyl)phenyl acetate Acetic acid[4-[[[5-[(4-acetoxybenzyl)thio]-2-[4,5-bis(methylthio)-1,3-dithiol-2-ylidene]-1,3-dithiol-4-yl]thio]methyl]phenyl]ester Acetic acid[4-[[[5-[(4-acetyloxyphenyl)methylthio]-2-[4,5-bis(methylthio)-1,3-dithiol-2-ylidene]-1,3-dithiol-4-yl]thio]methyl]phenyl]ester [4-[[5-[(4-acetoxyphenyl)methylsulfanyl]-2-[4,5-bis(methylsulfanyl)-1,3-dithiol-2-ylidene]-1,3-dithiol-4-yl]sulfanylmethyl]phenyl]acetate [4-[[5-[(4-acetyloxyphenyl)methylsulfanyl]-2-[4,5-bis(methylsulfanyl)-1,3-dithiol-2-ylidene]-1,3-dithiol-4-yl]sulfanylmethyl]phenyl]acetate [4-[[5-[(4-acetyloxyphenyl)methylsulfanyl]-2-[4,5-bis(methylsulfanyl)-1,3-dithiol-2-ylidene]-1,3-dithiol-4-yl]sulfanylmethyl]phenyl]ethanoate Acetic acid [4-[[[5-[(4-acetyloxyphenyl)methylthio]-2-[4,5-bis(methylthio)-1,3-dithiol-2-ylidene]-1,3-dithiol-4-yl]thio]methyl]phenyl] ester [4-[[5-[(4-acetyloxyphenyl)methylsulfanyl]-2-[4,5-bis(methylsulfanyl)-1,3-dithiol-2-ylidene]-1,3-dithiol-4-yl]sulfanylmethyl]phenyl] acetate [4-[[5-[(4-acetoxyphenyl)methylsulfanyl]-2-[4,5-bis(methylsulfanyl)-1,3-dithiol-2-ylidene]-1,3-dithiol-4-yl]sulfanylmethyl]phenyl] acetate [4-[[5-[(4-acetyloxyphenyl)methylsulfanyl]-2-[4,5-bis(methylsulfanyl)-1,3-dithiol-2-ylidene]-1,3-dithiol-4-yl]sulfanylmethyl]phenyl] ethanoate
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Formula C26H24O4S8
InChI InChI=1S/C26H24O4S8/c1-15(27)29-19-9-5-17(6-10-19)13-33-23-24(34-14-18-7-11-20(12-8-18)30-16(2)28)38-26(37-23)25-35-21(31-3)22(32-4)36-25/h5-12H,13-14H2,1-4H3
InChIKey AOIPPSVHFNAGKJ-UHFFFAOYSA-N
Molecular Weight 656.954 g/mol
SMILES C1(=C2SC(SC)=C(S2)SC)SC(SCc2ccc(OC(=O)C)cc2)=C(S1)SCc1ccc(OC(=O)C)cc1
SPLASH splash10-0a4i-0901005000-712f8d84e7a0a95866c6
Source of Spectrum KC-0-2718-5
Wiley ID 782269