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4,4'-(3,4-Dimethylthieno[2,3-b]thiophene-2,5-diyl)bis(2-(2-(4-chlorobenzylidene)hydrazinyl)thiazole)
SpectraBase Compound ID CuFUH9SgKRI
InChI InChI=1S/C28H20Cl2N6S4/c1-15-23-16(2)25(22-14-38-28(34-22)36-32-12-18-5-9-20(30)10-6-18)40-26(23)39-24(15)21-13-37-27(33-21)35-31-11-17-3-7-19(29)8-4-17/h3-14H,1-2H3,(H,33,35)(H,34,36)
InChIKey KGIPAPDNXCAWQA-UHFFFAOYSA-N
Mol Weight 639.7 g/mol
Molecular Formula C28H20Cl2N6S4
Exact Mass 638.000935 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ARhtDpLVjIE
Name 4,4'-(3,4-Dimethylthieno[2,3-b]thiophene-2,5-diyl)bis(2-(2-(4-chlorobenzylidene)hydrazinyl)thiazole)
Appearance Brown microcystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H20Cl2N6S4
InChI InChI=1S/C28H20Cl2N6S4/c1-15-23-16(2)25(22-14-38-28(34-22)36-32-12-18-5-9-20(30)10-6-18)40-26(23)39-24(15)21-13-37-27(33-21)35-31-11-17-3-7-19(29)8-4-17/h3-14H,1-2H3,(H,33,35)(H,34,36)
InChIKey KGIPAPDNXCAWQA-UHFFFAOYSA-N
Instrument Name GCMS-Q1000-EX Shimadzu, GCMS 5988-A HP
Ionization Type EI
Literature Reference DOI 10.1002/jhet.2869
Molecular Weight 639.656 g/mol
SMILES N(N=Cc1ccc(cc1)Cl)c1nc(-c2sc3c(c(c(-c4csc(n4)NN=Cc4ccc(cc4)Cl)s3)C)c2C)cs1
SPLASH splash10-0ikj-9420764000-72f29b8b91296b8641c8
Source of Spectrum Y-54-2693-5q
Wiley ID 1878535