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4,4'-(3,4-Diphenylthieno[2,3-b]thiophene-2,5-diyl)bis(2-(2-(4-methylbenzylidene) hydrazinyl)thiazole)
SpectraBase Compound ID GhzD6fcJIgO
InChI InChI=1S/C40H30N6S4/c1-25-13-17-27(18-14-25)21-41-45-39-43-31(23-47-39)36-33(29-9-5-3-6-10-29)35-34(30-11-7-4-8-12-30)37(50-38(35)49-36)32-24-48-40(44-32)46-42-22-28-19-15-26(2)16-20-28/h3-24H,1-2H3,(H,43,45)(H,44,46)
InChIKey QJJFJJURQHRCGM-UHFFFAOYSA-N
Mol Weight 723.0 g/mol
Molecular Formula C40H30N6S4
Exact Mass 722.14148 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8bW1gpHvnuV
Name 4,4'-(3,4-Diphenylthieno[2,3-b]thiophene-2,5-diyl)bis(2-(2-(4-methylbenzylidene) hydrazinyl)thiazole)
Appearance Yellow microcystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C40H30N6S4
InChI InChI=1S/C40H30N6S4/c1-25-13-17-27(18-14-25)21-41-45-39-43-31(23-47-39)36-33(29-9-5-3-6-10-29)35-34(30-11-7-4-8-12-30)37(50-38(35)49-36)32-24-48-40(44-32)46-42-22-28-19-15-26(2)16-20-28/h3-24H,1-2H3,(H,43,45)(H,44,46)
InChIKey QJJFJJURQHRCGM-UHFFFAOYSA-N
Instrument Name GCMS-Q1000-EX Shimadzu, GCMS 5988-A HP
Ionization Type EI
Literature Reference DOI 10.1002/jhet.2869
Molecular Weight 722.962 g/mol
SMILES N(N=Cc1ccc(cc1)C)c1nc(-c2c(c3c(c(-c4nc(sc4)NN=Cc4ccc(cc4)C)sc3s2)-c2ccccc2)-c2ccccc2)cs1
SPLASH splash10-004i-1239032300-6cddbc91507c7f503e34
Source of Spectrum Y-54-2691-5b
Wiley ID 1878520