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3-[5-(2-cyano-2-(benzo[d]dioxolane)ethienyl]-1-(2-thienyl)benzo[c]thiophene
SpectraBase Compound ID 1LxWga6ERL1
InChI InChI=1S/C26H15NO2S3/c27-14-17(16-7-9-21-22(13-16)29-15-28-21)12-18-8-10-24(31-18)26-20-5-2-1-4-19(20)25(32-26)23-6-3-11-30-23/h1-13H,15H2/b17-12+
InChIKey WRKWNKJMXOKZPP-SFQUDFHCSA-N
Mol Weight 469.59 g/mol
Molecular Formula C26H15NO2S3
Exact Mass 469.026492 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4syLZ0uOXDc
Name 3-[5-(2-cyano-2-(benzo[d]dioxolane)ethienyl]-1-(2-thienyl)benzo[c]thiophene
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Formula C26H15NO2S3
InChI InChI=1S/C26H15NO2S3/c27-14-17(16-7-9-21-22(13-16)29-15-28-21)12-18-8-10-24(31-18)26-20-5-2-1-4-19(20)25(32-26)23-6-3-11-30-23/h1-13H,15H2/b17-12+
InChIKey WRKWNKJMXOKZPP-SFQUDFHCSA-N
Molecular Weight 469.591 g/mol
SMILES c1(sc(-c2sccc2)c2c1cccc2)-c1sc(\C=C\(c2cc3OCOc3cc2)C#N)cc1
SPLASH splash10-05fr-0920200000-4075117d9dc757b9608b
Source of Spectrum J-63-3111-21
Synonyms 3-[5-(2-cyano-2-(benzo[d]dioxolane)ethenyl]thienyl-1-(2-thienyl)benzo[c]thiophene (Z)-2-(1,3-benzodioxol-5-yl)-3-[5-(3-thiophen-2-yl-2-benzothiophen-1-yl)-2-thiophenyl]-2-propenenitrile (Z)-2-(1,3-benzodioxol-5-yl)-3-[5-[3-(2-thienyl)-2-benzothiophen-1-yl]-2-thienyl]prop-2-enenitrile (Z)-2-(1,3-benzodioxol-5-yl)-3-[5-(3-thiophen-2-yl-2-benzothiophen-1-yl)thiophen-2-yl]prop-2-enenitrile
Wiley ID 1392629