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5,5'-((Sulfonylbis(4,1-phenylene))bis(diazene-2,1-diyl))bis(4-methyl-2-(2-(1-(naphthalen-2-yl)ethylidene)hydrazinyl)thiazole)
SpectraBase Compound ID BXE2QqSHVJx
InChI InChI=1S/C44H36N10O2S3/c1-27(33-15-13-31-9-5-7-11-35(31)25-33)47-53-43-45-29(3)41(57-43)51-49-37-17-21-39(22-18-37)59(55,56)40-23-19-38(20-24-40)50-52-42-30(4)46-44(58-42)54-48-28(2)34-16-14-32-10-6-8-12-36(32)26-34/h5-26H,1-4H3,(H,45,53)(H,46,54)
InChIKey RKENHYQGTJKRMP-UHFFFAOYSA-N
Mol Weight 833.0 g/mol
Molecular Formula C44H36N10O2S3
Exact Mass 832.218484 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1n7xzFDUFSC
Name 5,5'-((Sulfonylbis(4,1-phenylene))bis(diazene-2,1-diyl))bis(4-methyl-2-(2-(1-(naphthalen-2-yl)ethylidene)hydrazinyl)thiazole)
Appearance Red solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C44H36N10O2S3
InChI InChI=1S/C44H36N10O2S3/c1-27(33-15-13-31-9-5-7-11-35(31)25-33)47-53-43-45-29(3)41(57-43)51-49-37-17-21-39(22-18-37)59(55,56)40-23-19-38(20-24-40)50-52-42-30(4)46-44(58-42)54-48-28(2)34-16-14-32-10-6-8-12-36(32)26-34/h5-26H,1-4H3,(H,45,53)(H,46,54)
InChIKey RKENHYQGTJKRMP-UHFFFAOYSA-N
Instrument Name Shimadzu GCeMS-QP1000 EX
Ionization Type EI
Literature Reference DOI 10.1002/jhet.2741
Molecular Weight 833.020 g/mol
SMILES N(N=C(c1ccc2c(cccc2)c1)C)c1sc(N=Nc2ccc(S(c3ccc(N=Nc4sc(nc4C)NN=C(C)c4cc5c(cccc5)cc4)cc3)(=O)=O)cc2)c(n1)C
SPLASH splash10-00b9-3904200200-4d5f71a3872b871a6eba
Source of Spectrum Y-54-1541-19
Wiley ID 1878274