![Benzoic acid, 5-[[4'-[(2,6-diamino-3-methyl-5-sulfophenyl)azo]-3,3'-dimethyl[1,1'-biphenyl]-4-yl]azo]-2-hydroxy-, disodium salt](/api/spectrum/51mUBCskZp2/structure.png?h=300&w=458 "Benzoic acid, 5-[[4'-[(2,6-diamino-3-methyl-5-sulfophenyl)azo]-3,3'-dimethyl[1,1'-biphenyl]-4-yl]azo]-2-hydroxy-, disodium salt")
| SpectraBase Compound ID | ExTKdLYNMbN |
|---|---|
| InChI | InChI=1S/C28H26N6O6S.2Na/c1-14-10-17(4-7-21(14)32-31-19-6-9-23(35)20(13-19)28(36)37)18-5-8-22(15(2)11-18)33-34-27-25(29)16(3)12-24(26(27)30)41(38,39)40;;/h4-13,35H,29-30H2,1-3H3,(H,36,37)(H,38,39,40);;/q;2*+1/p-2/b32-31+,34-33+;; |
| InChIKey | VHGDEGWDHMWQLR-DUCFOALUSA-L |
| Mol Weight | 618.57553856 g/mol |
| Molecular Formula | C28H24N6Na2O6S |
| Exact Mass | 618.127342 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | 51mUBCskZp2 |
|---|---|
| Name | Benzoic acid, 5-[[4'-[(2,6-diamino-3-methyl-5-sulfophenyl)azo]-3,3'-dimethyl[1,1'-biphenyl]-4-yl]azo]-2-hydroxy-, disodium salt |
| CAS Registry Number | 6637-88-3 |
| Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C28H24N6Na2O6S |
| InChI | InChI=1S/C28H26N6O6S.2Na/c1-14-10-17(4-7-21(14)32-31-19-6-9-23(35)20(13-19)28(36)37)18-5-8-22(15(2)11-18)33-34-27-25(29)16(3)12-24(26(27)30)41(38,39)40;;/h4-13,35H,29-30H2,1-3H3,(H,36,37)(H,38,39,40);;/q;2*+1/p-2/b32-31+,34-33+;; |
| InChIKey | VHGDEGWDHMWQLR-DUCFOALUSA-L |
| Instrument Name | Bruker IFS 85 |
| Technique | KBr-Pellet |