![Benzoic acid, 5-[[4'-[[8-amino-1-hydroxy-4,6-disulfo-7-[(4-4-sulfophenyl)azo-2-naphthaleny]azo][1,1'-biphenyl]-4-yl]azo-2-2-hydroxy, tetrasodium salt](/api/spectrum/1lwbTv7HqXH/structure.png?h=300&w=458 "Benzoic acid, 5-[[4'-[[8-amino-1-hydroxy-4,6-disulfo-7-[(4-4-sulfophenyl)azo-2-naphthaleny]azo][1,1'-biphenyl]-4-yl]azo-2-2-hydroxy, tetrasodium salt")
| SpectraBase Compound ID | 7aJo1tEJL3v |
|---|---|
| InChI | InChI=1S/C35H25N7O13S3.4Na/c36-32-31-26(16-30(58(53,54)55)33(32)42-39-22-9-12-24(13-10-22)56(47,48)49)29(57(50,51)52)17-27(34(31)44)41-38-21-7-3-19(4-8-21)18-1-5-20(6-2-18)37-40-23-11-14-28(43)25(15-23)35(45)46;;;;/h1-17,43-44H,36H2,(H,45,46)(H,47,48,49)(H,50,51,52)(H,53,54,55);;;;/q;4*+1/p-4/b40-37+,41-38+,42-39-;;;; |
| InChIKey | XUIQOKMQVFQDDU-NRMDQVSSSA-J |
| Mol Weight | 935.72807713 g/mol |
| Molecular Formula | C35H21N7Na4O13S3 |
| Exact Mass | 934.995024 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | 1lwbTv7HqXH |
|---|---|
| Name | Benzoic acid, 5-[[4'-[[8-amino-1-hydroxy-4,6-disulfo-7-[(4-4-sulfophenyl)azo-2-naphthaleny]azo][1,1'-biphenyl]-4-yl]azo-2-2-hydroxy, tetrasodium salt |
| CAS Registry Number | 6826-70-6 |
| Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C35H21N7Na4O13S3 |
| InChI | InChI=1S/C35H25N7O13S3.4Na/c36-32-31-26(16-30(58(53,54)55)33(32)42-39-22-9-12-24(13-10-22)56(47,48)49)29(57(50,51)52)17-27(34(31)44)41-38-21-7-3-19(4-8-21)18-1-5-20(6-2-18)37-40-23-11-14-28(43)25(15-23)35(45)46;;;;/h1-17,43-44H,36H2,(H,45,46)(H,47,48,49)(H,50,51,52)(H,53,54,55);;;;/q;4*+1/p-4/b40-37+,41-38+,42-39-;;;; |
| InChIKey | XUIQOKMQVFQDDU-NRMDQVSSSA-J |
| Instrument Name | Bruker IFS 85 |
| Technique | KBr-Pellet |