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(E)-7,7'-Dimethoxy-4,4'-bis-nonyloxy-1H,1'H-[2,2']biindolylidene-3,3'-dione
SpectraBase Compound ID 7q2mZBdXqXT
InChI InChI=1S/C36H50N2O6/c1-5-7-9-11-13-15-17-23-43-25-19-21-27(41-3)31-29(25)35(39)33(37-31)34-36(40)30-26(20-22-28(42-4)32(30)38-34)44-24-18-16-14-12-10-8-6-2/h19-22,37-38H,5-18,23-24H2,1-4H3/b34-33+
InChIKey ZDIMFZNECXJNMF-JEIPZWNWSA-N
Mol Weight 606.8 g/mol
Molecular Formula C36H50N2O6
Exact Mass 606.366887 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1Z4EoMoHZgs
Name (E)-7,7'-Dimethoxy-4,4'-bis-nonyloxy-1H,1'H-[2,2']biindolylidene-3,3'-dione
Comments Less than 3 mono-isotopic peaks
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Formula C36H50N2O6
InChI InChI=1S/C36H50N2O6/c1-5-7-9-11-13-15-17-23-43-25-19-21-27(41-3)31-29(25)35(39)33(37-31)34-36(40)30-26(20-22-28(42-4)32(30)38-34)44-24-18-16-14-12-10-8-6-2/h19-22,37-38H,5-18,23-24H2,1-4H3/b34-33+
InChIKey ZDIMFZNECXJNMF-JEIPZWNWSA-N
Molecular Weight 606.804 g/mol
SMILES N1c2c(ccc(c2C(\C1=C\1C(c2c(ccc(c2N1)OC)OCCCCCCCCC)=O)=O)OCCCCCCCCC)OC
SPLASH splash10-0a4i-0000109000-a5799c90d0285ae36948
Source of Spectrum H-86-2002-3
Synonyms 2-[1',3'-Dihydro-4'-nonyloxy-7'-methoxy-3'-oxo-2H-indol-2'-ylidene)-1,2-dihydro-7-methoxy-3H-indol-3-one 4,4'-bis(nonyloxy)-7,7'-dimethoxyindigotin 7-methoxy-2-[(2E)-7-methoxy-4-(nonyloxy)-3-oxo-2,3-dihydro-1H-indol-2-ylidene]-4-(nonyloxy)-2,3-dihydro-1H-indol-3-one
Wiley ID 1525474