![1,5-Naphthalenedisulfonic acid, 3-[[4-[[1-hydroxy-6-(phenylamino)-3-sulfo-2-naphthalenyl]azo]-5-methoxy-2-methylphenyl]azo]-, trisodium salt](/api/spectrum/3zmPiTQVabe/structure.png?h=300&w=458 "1,5-Naphthalenedisulfonic acid, 3-[[4-[[1-hydroxy-6-(phenylamino)-3-sulfo-2-naphthalenyl]azo]-5-methoxy-2-methylphenyl]azo]-, trisodium salt")
| SpectraBase Compound ID | L3Gvw4RtMz6 |
|---|---|
| InChI | InChI=1S/C34H27N5O11S3.3Na/c1-19-13-28(38-39-33-32(53(47,48)49)15-20-14-22(11-12-24(20)34(33)40)35-21-7-4-3-5-8-21)29(50-2)18-27(19)37-36-23-16-26-25(31(17-23)52(44,45)46)9-6-10-30(26)51(41,42)43;;;/h3-18,35,40H,1-2H3,(H,41,42,43)(H,44,45,46)(H,47,48,49);;;/q;3*+1/p-3/b37-36+,39-38?;;; |
| InChIKey | VRVDFJOCCWSFLI-WUVGXYFASA-K |
| Mol Weight | 843.73930785 g/mol |
| Molecular Formula | C34H24N5Na3O11S3 |
| Exact Mass | 843.032753 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | 3zmPiTQVabe |
|---|---|
| Name | 1,5-Naphthalenedisulfonic acid, 3-[[4-[[1-hydroxy-6-(phenylamino)-3-sulfo-2-naphthalenyl]azo]-5-methoxy-2-methylphenyl]azo]-, trisodium salt |
| CAS Registry Number | 6227-20-9 |
| Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C34H24N5Na3O11S3 |
| InChI | InChI=1S/C34H27N5O11S3.3Na/c1-19-13-28(38-39-33-32(53(47,48)49)15-20-14-22(11-12-24(20)34(33)40)35-21-7-4-3-5-8-21)29(50-2)18-27(19)37-36-23-16-26-25(31(17-23)52(44,45)46)9-6-10-30(26)51(41,42)43;;;/h3-18,35,40H,1-2H3,(H,41,42,43)(H,44,45,46)(H,47,48,49);;;/q;3*+1/p-3/b37-36+,39-38?;;; |
| InChIKey | VRVDFJOCCWSFLI-WUVGXYFASA-K |
| Instrument Name | Bruker IFS 85 |
| Technique | KBr-Pellet |