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4,4'-(3,4-Diphenylthieno[2,3-b]thiophene-2,5-diyl)bis(2-(2-(4-methoxybenzylidene)hydrazinyl)thiazole)
SpectraBase Compound ID E9KcN1P2AqG
InChI InChI=1S/C40H30N6O2S4/c1-47-29-17-13-25(14-18-29)21-41-45-39-43-31(23-49-39)36-33(27-9-5-3-6-10-27)35-34(28-11-7-4-8-12-28)37(52-38(35)51-36)32-24-50-40(44-32)46-42-22-26-15-19-30(48-2)20-16-26/h3-24H,1-2H3,(H,43,45)(H,44,46)
InChIKey ZMAXRBDMVPNTPJ-UHFFFAOYSA-N
Mol Weight 755.0 g/mol
Molecular Formula C40H30N6O2S4
Exact Mass 754.131309 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5qxGJPOTLaG
Name 4,4'-(3,4-Diphenylthieno[2,3-b]thiophene-2,5-diyl)bis(2-(2-(4-methoxybenzylidene)hydrazinyl)thiazole)
Appearance Brown microcystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C40H30N6O2S4
InChI InChI=1S/C40H30N6O2S4/c1-47-29-17-13-25(14-18-29)21-41-45-39-43-31(23-49-39)36-33(27-9-5-3-6-10-27)35-34(28-11-7-4-8-12-28)37(52-38(35)51-36)32-24-50-40(44-32)46-42-22-26-15-19-30(48-2)20-16-26/h3-24H,1-2H3,(H,43,45)(H,44,46)
InChIKey ZMAXRBDMVPNTPJ-UHFFFAOYSA-N
Instrument Name GCMS-Q1000-EX Shimadzu, GCMS 5988-A HP
Ionization Type EI
Literature Reference DOI 10.1002/jhet.2869
Molecular Weight 754.960 g/mol
SMILES N(N=Cc1ccc(cc1)OC)c1nc(-c2c(c3c(c(-c4nc(sc4)NN=Cc4ccc(cc4)OC)sc3s2)-c2ccccc2)-c2ccccc2)cs1
SPLASH splash10-0fb9-2129032200-0e721e3c4097a68d2ce8
Source of Spectrum Y-54-2691-5c
Wiley ID 1878521