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4,4'-(3,4-Diphenylthieno[2,3-b]thiophene-2,5-diyl)bis(2-(2-(2,6-dichlorobenzylidene)hydrazinyl)thiazole)
SpectraBase Compound ID HIxqfdiviNg
InChI InChI=1S/C38H22Cl4N6S4/c39-25-13-7-14-26(40)23(25)17-43-47-37-45-29(19-49-37)34-31(21-9-3-1-4-10-21)33-32(22-11-5-2-6-12-22)35(52-36(33)51-34)30-20-50-38(46-30)48-44-18-24-27(41)15-8-16-28(24)42/h1-20H,(H,45,47)(H,46,48)
InChIKey HFHWBGZAJWECMC-UHFFFAOYSA-N
Mol Weight 832.7 g/mol
Molecular Formula C38H22Cl4N6S4
Exact Mass 829.95429 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4cdbZW32mG
Name 4,4'-(3,4-Diphenylthieno[2,3-b]thiophene-2,5-diyl)bis(2-(2-(2,6-dichlorobenzylidene)hydrazinyl)thiazole)
Appearance Brown microcystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C38H22Cl4N6S4
InChI InChI=1S/C38H22Cl4N6S4/c39-25-13-7-14-26(40)23(25)17-43-47-37-45-29(19-49-37)34-31(21-9-3-1-4-10-21)33-32(22-11-5-2-6-12-22)35(52-36(33)51-34)30-20-50-38(46-30)48-44-18-24-27(41)15-8-16-28(24)42/h1-20H,(H,45,47)(H,46,48)
InChIKey HFHWBGZAJWECMC-UHFFFAOYSA-N
Instrument Name GCMS-Q1000-EX Shimadzu, GCMS 5988-A HP
Ionization Type EI
Literature Reference DOI 10.1002/jhet.2869
Molecular Weight 832.688 g/mol
SMILES N(N=Cc1c(cccc1Cl)Cl)c1nc(-c2sc3c(c(c(-c4csc(n4)NN=Cc4c(cccc4Cl)Cl)s3)-c3ccccc3)c2-c2ccccc2)cs1
SPLASH splash10-03di-9202067740-c17498c3c538a31541bd
Source of Spectrum Y-54-2692-5l
Wiley ID 1878530