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4-Amino-2-(diethylamino)-5-{2-(diethylamino)-5-[4-(perfluorohexylsulfonyl)phenylazo]thiazol-4-yl}thiazole
SpectraBase Compound ID 9q3RdrvL32w
InChI InChI=1S/C26H26F13N7O2S3/c1-5-45(6-2)19-41-15(16-17(40)42-20(49-16)46(7-3)8-4)18(50-19)44-43-13-9-11-14(12-10-13)51(47,48)26(38,39)24(33,34)22(29,30)21(27,28)23(31,32)25(35,36)37/h9-12H,5-8,40H2,1-4H3/b44-43+
InChIKey IIPJRLAMJYTLEM-VGFSZAGXSA-N
Mol Weight 811.7 g/mol
Molecular Formula C26H26F13N7O2S3
Exact Mass 811.110253 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8ooyobUZI76
Name 4-Amino-2-(diethylamino)-5-{2-(diethylamino)-5-[4-(perfluorohexylsulfonyl)phenylazo]thiazol-4-yl}thiazole
Alternate Name(s) 5-[2-(diethylamino)-5-[(E)-2-{4-[(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexane)sulfonyl]phenyl}diazen-1-yl]-1,3-thiazol-4-yl]-2-N,2-N-diethyl-1,3-thiazole-2,4-diamine
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Formula C26H26F13N7O2S3
InChI InChI=1S/C26H26F13N7O2S3/c1-5-45(6-2)19-41-15(16-17(40)42-20(49-16)46(7-3)8-4)18(50-19)44-43-13-9-11-14(12-10-13)51(47,48)26(38,39)24(33,34)22(29,30)21(27,28)23(31,32)25(35,36)37/h9-12H,5-8,40H2,1-4H3/b44-43+
InChIKey IIPJRLAMJYTLEM-VGFSZAGXSA-N
Molecular Weight 811.700 g/mol
SMILES Nc1nc(sc1-c1c(\N=N\c2ccc(S(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(=O)=O)cc2)sc(N(CC)CC)n1)N(CC)CC
SPLASH splash10-0097-6010900020-a05e2671998120ed74d8
Source of Spectrum K-2001-385-3
Wiley ID 1580252