![2-Naphthalenesulfonic acid, 7-[[4-[[6-[(4-aminobenzoyl)amino]-1-hydroxy-3-sulfo-2-naphthalenyl]azo]benzoyl]amino]-4-hydroxy-3-[(4-methylphenyl)azo]-, disodium salt](/api/spectrum/ArOkWne931T/structure.png?h=300&w=458 "2-Naphthalenesulfonic acid, 7-[[4-[[6-[(4-aminobenzoyl)amino]-1-hydroxy-3-sulfo-2-naphthalenyl]azo]benzoyl]amino]-4-hydroxy-3-[(4-methylphenyl)azo]-, disodium salt")
| SpectraBase Compound ID | 1qCLZIX9gFI |
|---|---|
| InChI | InChI=1S/C41H31N7O10S2.2Na/c1-22-2-10-28(11-3-22)45-47-36-34(59(53,54)55)20-26-19-31(15-17-32(26)38(36)49)44-41(52)24-6-12-29(13-7-24)46-48-37-35(60(56,57)58)21-25-18-30(14-16-33(25)39(37)50)43-40(51)23-4-8-27(42)9-5-23;;/h2-21,49-50H,42H2,1H3,(H,43,51)(H,44,52)(H,53,54,55)(H,56,57,58);;/q;2*+1/p-2/b47-45-,48-46-;; |
| InChIKey | TZOYQXQOICATPM-QVFNQICFSA-L |
| Mol Weight | 889.82153856 g/mol |
| Molecular Formula | C41H29N7Na2O10S2 |
| Exact Mass | 889.121271 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | ArOkWne931T |
|---|---|
| Name | 2-Naphthalenesulfonic acid, 7-[[4-[[6-[(4-aminobenzoyl)amino]-1-hydroxy-3-sulfo-2-naphthalenyl]azo]benzoyl]amino]-4-hydroxy-3-[(4-methylphenyl)azo]-, disodium salt |
| CAS Registry Number | 5938-87-4 |
| Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C41H29N7Na2O10S2 |
| InChI | InChI=1S/C41H31N7O10S2.2Na/c1-22-2-10-28(11-3-22)45-47-36-34(59(53,54)55)20-26-19-31(15-17-32(26)38(36)49)44-41(52)24-6-12-29(13-7-24)46-48-37-35(60(56,57)58)21-25-18-30(14-16-33(25)39(37)50)43-40(51)23-4-8-27(42)9-5-23;;/h2-21,49-50H,42H2,1H3,(H,43,51)(H,44,52)(H,53,54,55)(H,56,57,58);;/q;2*+1/p-2/b47-45-,48-46-;; |
| InChIKey | TZOYQXQOICATPM-QVFNQICFSA-L |
| Instrument Name | Bruker IFS 85 |
| Technique | KBr-Pellet |