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3,3'-(2,2'-(5,5'-((Sulfonylbis(4,1-phenylene))bis(diazene-2,1-diyl))bis(4-methylthiazole-5,2-diyl))bis(hydrazin-2-yl-1-ylidene))bis(indolin-2-one)
SpectraBase Compound ID A936czp2E3G
InChI InChI=1S/C36H26N12O4S3/c1-19-33(53-35(37-19)47-43-29-25-7-3-5-9-27(25)39-31(29)49)45-41-21-11-15-23(16-12-21)55(51,52)24-17-13-22(14-18-24)42-46-34-20(2)38-36(54-34)48-44-30-26-8-4-6-10-28(26)40-32(30)50/h3-18H,1-2H3,(H,37,47)(H,38,48)(H,39,43,49)(H,40,44,50)
InChIKey FZXCYHWCJOLYGD-UHFFFAOYSA-N
Mol Weight 786.9 g/mol
Molecular Formula C36H26N12O4S3
Exact Mass 786.136211 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DGbWOTg8ei6
Name 3,3'-(2,2'-(5,5'-((Sulfonylbis(4,1-phenylene))bis(diazene-2,1-diyl))bis(4-methylthiazole-5,2-diyl))bis(hydrazin-2-yl-1-ylidene))bis(indolin-2-one)
Appearance Red solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C36H26N12O4S3
InChI InChI=1S/C36H26N12O4S3/c1-19-33(53-35(37-19)47-43-29-25-7-3-5-9-27(25)39-31(29)49)45-41-21-11-15-23(16-12-21)55(51,52)24-17-13-22(14-18-24)42-46-34-20(2)38-36(54-34)48-44-30-26-8-4-6-10-28(26)40-32(30)50/h3-18H,1-2H3,(H,37,47)(H,38,48)(H,39,43,49)(H,40,44,50)
InChIKey FZXCYHWCJOLYGD-UHFFFAOYSA-N
Instrument Name Shimadzu GCeMS-QP1000 EX
Ionization Type EI
Literature Reference DOI 10.1002/jhet.2741
Molecular Weight 786.864 g/mol
SMILES N(N=C1C(Nc2c1cccc2)=O)c1sc(N=Nc2ccc(S(c3ccc(N=Nc4sc(nc4C)NN=C4C(Nc5c4cccc5)=O)cc3)(=O)=O)cc2)c(n1)C
SPLASH splash10-0089-9323420100-29b6a9d19059ede6ea70
Source of Spectrum Y-54-1541-22
Wiley ID 1878277