![2,7-Naphthalenedisulfonic acid, 5-amino-4-hydroxy-3-[[4'-[[1-hydroxy-6-(phenylamino)-3-sulfo-2-naphthalenyl]azo]-3,3'-dimethoxy[1,1'-biphenyl]-4-yl]azo]-, trisodium salt](/api/spectrum/CtPI6rMrW1p/structure.png?h=300&w=458 "2,7-Naphthalenedisulfonic acid, 5-amino-4-hydroxy-3-[[4'-[[1-hydroxy-6-(phenylamino)-3-sulfo-2-naphthalenyl]azo]-3,3'-dimethoxy[1,1'-biphenyl]-4-yl]azo]-, trisodium salt")
| SpectraBase Compound ID | 10EoXUr0Xm |
|---|---|
| InChI | InChI=1S/C40H32N6O13S3.3Na/c1-58-32-16-21(8-12-30(32)43-45-37-34(61(52,53)54)18-23-14-26(10-11-28(23)39(37)47)42-25-6-4-3-5-7-25)22-9-13-31(33(17-22)59-2)44-46-38-35(62(55,56)57)19-24-15-27(60(49,50)51)20-29(41)36(24)40(38)48;;;/h3-20,42,47-48H,41H2,1-2H3,(H,49,50,51)(H,52,53,54)(H,55,56,57);;;/q;3*+1/p-3/b45-43+,46-44+;;; |
| InChIKey | RRGWJSPYUXZMFT-PRJGFXSFSA-K |
| Mol Weight | 966.85030785 g/mol |
| Molecular Formula | C40H29N6Na3O13S3 |
| Exact Mass | 966.064781 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | CtPI6rMrW1p |
|---|---|
| Name | 2,7-Naphthalenedisulfonic acid, 5-amino-4-hydroxy-3-[[4'-[[1-hydroxy-6-(phenylamino)-3-sulfo-2-naphthalenyl]azo]-3,3'-dimethoxy[1,1'-biphenyl]-4-yl]azo]-, trisodium salt |
| CAS Registry Number | 6771-79-5 |
| Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C40H29N6Na3O13S3 |
| InChI | InChI=1S/C40H32N6O13S3.3Na/c1-58-32-16-21(8-12-30(32)43-45-37-34(61(52,53)54)18-23-14-26(10-11-28(23)39(37)47)42-25-6-4-3-5-7-25)22-9-13-31(33(17-22)59-2)44-46-38-35(62(55,56)57)19-24-15-27(60(49,50)51)20-29(41)36(24)40(38)48;;;/h3-20,42,47-48H,41H2,1-2H3,(H,49,50,51)(H,52,53,54)(H,55,56,57);;;/q;3*+1/p-3/b45-43+,46-44+;;; |
| InChIKey | RRGWJSPYUXZMFT-PRJGFXSFSA-K |
| Instrument Name | Bruker IFS 85 |
| Synonyms | H=acid(alk)(1)[-o-dianisidine-](2)(alk)N-phenyl-J=acid |
| Technique | KBr-Pellet |