![2,7-Naphthalenedisulfonic acid, 5-[[2,4-diamino-5-[(8-hydroxy-6-sulfo-2-naphthalenyl)azo]phenyl]azo]-4-hydroxy-3-[[4'-[(4-hydroxyphenyl)azo][1,1'-biphenyl]-4-yl]azo]-, trisodium salt](/api/spectrum/7paC9SiGdW5/structure.png?h=300&w=458 "2,7-Naphthalenedisulfonic acid, 5-[[2,4-diamino-5-[(8-hydroxy-6-sulfo-2-naphthalenyl)azo]phenyl]azo]-4-hydroxy-3-[[4'-[(4-hydroxyphenyl)azo][1,1'-biphenyl]-4-yl]azo]-, trisodium salt")
| SpectraBase Compound ID | CoRxNQ8HfQM |
|---|---|
| InChI | InChI=1S/C44H32N10O12S3.3Na/c45-35-21-36(46)38(22-37(35)51-50-30-10-5-25-15-33(68(61,62)63)20-40(56)34(25)18-30)52-53-39-19-32(67(58,59)60)16-26-17-41(69(64,65)66)43(44(57)42(26)39)54-49-28-8-3-24(4-9-28)23-1-6-27(7-2-23)47-48-29-11-13-31(55)14-12-29;;;/h1-22,55-57H,45-46H2,(H,58,59,60)(H,61,62,63)(H,64,65,66);;;/q;3*+1/p-3/b48-47?,51-50-,53-52-,54-49-;;; |
| InChIKey | BIIFGDQOZUDRFU-PQELFZBSSA-K |
| Mol Weight | 1054.92330785 g/mol |
| Molecular Formula | C44H29N10Na3O12S3 |
| Exact Mass | 1054.082163 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | 7paC9SiGdW5 |
|---|---|
| Name | 2,7-Naphthalenedisulfonic acid, 5-[[2,4-diamino-5-[(8-hydroxy-6-sulfo-2-naphthalenyl)azo]phenyl]azo]-4-hydroxy-3-[[4'-[(4-hydroxyphenyl)azo][1,1'-biphenyl]-4-yl]azo]-, trisodium salt |
| CAS Registry Number | 6471-44-9 |
| Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C44H29N10Na3O12S3 |
| InChI | InChI=1S/C44H32N10O12S3.3Na/c45-35-21-36(46)38(22-37(35)51-50-30-10-5-25-15-33(68(61,62)63)20-40(56)34(25)18-30)52-53-39-19-32(67(58,59)60)16-26-17-41(69(64,65)66)43(44(57)42(26)39)54-49-28-8-3-24(4-9-28)23-1-6-27(7-2-23)47-48-29-11-13-31(55)14-12-29;;;/h1-22,55-57H,45-46H2,(H,58,59,60)(H,61,62,63)(H,64,65,66);;;/q;3*+1/p-3/b48-47?,51-50-,53-52-,54-49-;;; |
| InChIKey | BIIFGDQOZUDRFU-PQELFZBSSA-K |
| Instrument Name | Bruker IFS 85 |
| Technique | KBr-Pellet |