SpectraBase Compound ID | 1snnY4hOQ05 |
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InChI | InChI=1S/C28H30N8O6S2.2Na/c1-13-9-17(5-7-19(13)33-35-27-23(29)15(3)11-21(25(27)31)43(37,38)39)18-6-8-20(14(2)10-18)34-36-28-24(30)16(4)12-22(26(28)32)44(40,41)42;;/h5-12H,29-32H2,1-4H3,(H,37,38,39)(H,40,41,42);;/q;2*+1/p-2/b35-33+,36-34+;; |
InChIKey | KJPDHFPPVKRMMG-UUIOKUIJSA-L |
Mol Weight | 682.68153856 g/mol |
Molecular Formula | C28H28N8Na2O6S2 |
Exact Mass | 682.136862 g/mol |
SpectraBase Spectrum ID | KjXxQ2Z1Sww |
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Name | Benzenesulfonic acid, 3,3'-[(3,3'-dimethyl[1,1'-biphenyl]-4,4'-diyl)bis(azo)]bis[2,4-diamino-5-methyl-, disodium salt |
CAS Registry Number | 6405-94-3 |
Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula | C28H28N8Na2O6S2 |
InChI | InChI=1S/C28H30N8O6S2.2Na/c1-13-9-17(5-7-19(13)33-35-27-23(29)15(3)11-21(25(27)31)43(37,38)39)18-6-8-20(14(2)10-18)34-36-28-24(30)16(4)12-22(26(28)32)44(40,41)42;;/h5-12H,29-32H2,1-4H3,(H,37,38,39)(H,40,41,42);;/q;2*+1/p-2/b35-33+,36-34+;; |
InChIKey | KJPDHFPPVKRMMG-UUIOKUIJSA-L |
Instrument Name | Bruker IFS 85 |
Technique | KBr-Pellet |