![Benzoic acid, 5-[[4'-[(1-amino-8-hydroxy-4,6-disulfo-2-naphthalenyl)azo][1,1'-biphenyl]-4-yl]azo]-2-hydroxy-, trisodium salt](/api/spectrum/DoExSoF2Nsw/structure.png?h=300&w=458 "Benzoic acid, 5-[[4'-[(1-amino-8-hydroxy-4,6-disulfo-2-naphthalenyl)azo][1,1'-biphenyl]-4-yl]azo]-2-hydroxy-, trisodium salt")
| SpectraBase Compound ID | BZ2X4kgpEtu |
|---|---|
| InChI | InChI=1S/C29H21N5O10S2.3Na/c30-28-23(14-26(46(42,43)44)22-12-20(45(39,40)41)13-25(36)27(22)28)34-32-18-7-3-16(4-8-18)15-1-5-17(6-2-15)31-33-19-9-10-24(35)21(11-19)29(37)38;;;/h1-14,35-36H,30H2,(H,37,38)(H,39,40,41)(H,42,43,44);;;/q;3*+1/p-3/b33-31+,34-32+;;; |
| InChIKey | NWDMNVCYRMFFCT-STMNGTSKSA-K |
| Mol Weight | 729.57730785 g/mol |
| Molecular Formula | C29H18N5Na3O10S2 |
| Exact Mass | 729.018817 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | DoExSoF2Nsw |
|---|---|
| Name | Benzoic acid, 5-[[4'-[(1-amino-8-hydroxy-4,6-disulfo-2-naphthalenyl)azo][1,1'-biphenyl]-4-yl]azo]-2-hydroxy-, trisodium salt |
| CAS Registry Number | 6426-56-8 |
| Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C29H18N5Na3O10S2 |
| InChI | InChI=1S/C29H21N5O10S2.3Na/c30-28-23(14-26(46(42,43)44)22-12-20(45(39,40)41)13-25(36)27(22)28)34-32-18-7-3-16(4-8-18)15-1-5-17(6-2-15)31-33-19-9-10-24(35)21(11-19)29(37)38;;;/h1-14,35-36H,30H2,(H,37,38)(H,39,40,41)(H,42,43,44);;;/q;3*+1/p-3/b33-31+,34-32+;;; |
| InChIKey | NWDMNVCYRMFFCT-STMNGTSKSA-K |
| Instrument Name | Bruker IFS 85 |
| Synonyms | Salicylacid(1)[-benzidin-](2)(ac)K acid |
| Technique | KBr-Pellet |