![Benzoic acid, 5-[[4'-[[6-(acetylamino)-1-hydroxy-3-sulfo-2-naphthalenyl]azo][1,1'-biphenyl]-4-yl]azo]-2-hydroxy-3-methyl-, disodium salt](/api/spectrum/4SWhtK3iwif/structure.png?h=300&w=458 "Benzoic acid, 5-[[4'-[[6-(acetylamino)-1-hydroxy-3-sulfo-2-naphthalenyl]azo][1,1'-biphenyl]-4-yl]azo]-2-hydroxy-3-methyl-, disodium salt")
| SpectraBase Compound ID | 6c1KX3S7fb2 |
|---|---|
| InChI | InChI=1S/C32H25N5O8S.2Na/c1-17-13-25(16-27(30(17)39)32(41)42)36-34-22-7-3-19(4-8-22)20-5-9-23(10-6-20)35-37-29-28(46(43,44)45)15-21-14-24(33-18(2)38)11-12-26(21)31(29)40;;/h3-16,39-40H,1-2H3,(H,33,38)(H,41,42)(H,43,44,45);;/q;2*+1/p-2/b36-34+,37-35+;; |
| InChIKey | WGYJAVZTFOCUER-AVRYKWKFSA-L |
| Mol Weight | 683.60253856 g/mol |
| Molecular Formula | C32H23N5Na2O8S |
| Exact Mass | 683.106272 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | 4SWhtK3iwif |
|---|---|
| Name | Benzoic acid, 5-[[4'-[[6-(acetylamino)-1-hydroxy-3-sulfo-2-naphthalenyl]azo][1,1'-biphenyl]-4-yl]azo]-2-hydroxy-3-methyl-, disodium salt |
| CAS Registry Number | 6655-94-3 |
| Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C32H23N5Na2O8S |
| InChI | InChI=1S/C32H25N5O8S.2Na/c1-17-13-25(16-27(30(17)39)32(41)42)36-34-22-7-3-19(4-8-22)20-5-9-23(10-6-20)35-37-29-28(46(43,44)45)15-21-14-24(33-18(2)38)11-12-26(21)31(29)40;;/h3-16,39-40H,1-2H3,(H,33,38)(H,41,42)(H,43,44,45);;/q;2*+1/p-2/b36-34+,37-35+;; |
| InChIKey | WGYJAVZTFOCUER-AVRYKWKFSA-L |
| Instrument Name | Bruker IFS 85 |
| Technique | KBr-Pellet |