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5,5'-[(3,3'-dimethyl-4,4'-biphenylene)bis(azo)]bis[6-amino-2-naphthalenesulfonic acid], disodium salt
SpectraBase Compound ID CatfT2eyxBT
InChI InChI=1S/C34H28N6O6S2.2Na/c1-19-15-21(5-13-31(19)37-39-33-27-9-7-25(47(41,42)43)17-23(27)3-11-29(33)35)22-6-14-32(20(2)16-22)38-40-34-28-10-8-26(48(44,45)46)18-24(28)4-12-30(34)36;;/h3-18H,35-36H2,1-2H3,(H,41,42,43)(H,44,45,46);;/q;2*+1/p-2/b39-37+,40-38+;;
InChIKey AADVAFSRHMQXEC-DVDDBBOFSA-L
Mol Weight 724.71753856 g/mol
Molecular Formula C34H26N6Na2O6S2
Exact Mass 724.115063 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EELljNN3cSB
Name 5,5'-[(3,3'-dimethyl-4,4'-biphenylene)bis(azo)]bis[6-amino-2-naphthalenesulfonic acid], disodium salt
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Formula C34H26N6Na2O6S2
InChI InChI=1S/C34H28N6O6S2.2Na/c1-19-15-21(5-13-31(19)37-39-33-27-9-7-25(47(41,42)43)17-23(27)3-11-29(33)35)22-6-14-32(20(2)16-22)38-40-34-28-10-8-26(48(44,45)46)18-24(28)4-12-30(34)36;;/h3-18H,35-36H2,1-2H3,(H,41,42,43)(H,44,45,46);;/q;2*+1/p-2/b39-37+,40-38+;;
InChIKey AADVAFSRHMQXEC-DVDDBBOFSA-L
Instrument Name Varian CFT-20
Sadtler NMR Number 45378M
Solvent Polysol-d