| SpectraBase Compound ID | 5dJAYYPEgam |
|---|---|
| InChI | InChI=1S/C30H26N12O9S3.3Na/c31-21-12-22(32)26(14-25(21)38-35-16-3-1-5-19(9-16)52(43,44)45)40-37-18-7-8-30(54(49,50)51)29(11-18)42-41-28-15-27(23(33)13-24(28)34)39-36-17-4-2-6-20(10-17)53(46,47)48;;;/h1-15H,31-34H2,(H,43,44,45)(H,46,47,48)(H,49,50,51);;;/q;3*+1/p-3/b38-35+,39-36+,40-37+,42-41+;;; |
| InChIKey | FNMUSJRVXAQLRS-ALCONERPSA-K |
| Mol Weight | 860.73830785 g/mol |
| Molecular Formula | C30H23N12Na3O9S3 |
| Exact Mass | 860.056617 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | 3dI38gT2qDo |
|---|---|
| Name | (Metanilic acid->m-phenylendiamine)<-2,4-diaminobenzol-1-sulfoacid->(m-phenylendiamine<-metanilacid) |
| CAS Registry Number | 6428-26-8 |
| Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C30H23N12Na3O9S3 |
| InChI | InChI=1S/C30H26N12O9S3.3Na/c31-21-12-22(32)26(14-25(21)38-35-16-3-1-5-19(9-16)52(43,44)45)40-37-18-7-8-30(54(49,50)51)29(11-18)42-41-28-15-27(23(33)13-24(28)34)39-36-17-4-2-6-20(10-17)53(46,47)48;;;/h1-15H,31-34H2,(H,43,44,45)(H,46,47,48)(H,49,50,51);;;/q;3*+1/p-3/b38-35+,39-36+,40-37+,42-41+;;; |
| InChIKey | FNMUSJRVXAQLRS-ALCONERPSA-K |
| Instrument Name | Bruker IFS 85 |
| Synonyms | Benzenesulfonic acid, 2,4-bis[[2,4-diamino-5-[(3-sulfophenyl)azo]phenyl]azo]-, trisodium salt |
| Technique | KBr-Pellet |