![Sodium 5-({4-[(3-carboxy-4-hydroxy-5-methylphenyl)(3-carboxy-5-methyl-4-oxo-2,5-cyclohexadien-1-ylidene)methyl]phenyl}amino)-2-methylbenzenesulfonate](/api/spectrum/26bHjXwsLhu/structure.png?h=300&w=458 "Sodium 5-({4-[(3-carboxy-4-hydroxy-5-methylphenyl)(3-carboxy-5-methyl-4-oxo-2,5-cyclohexadien-1-ylidene)methyl]phenyl}amino)-2-methylbenzenesulfonate")
| SpectraBase Compound ID | 6E3K2UZSbPB |
|---|---|
| InChI | InChI=1S/C30H25NO9S.Na/c1-15-4-7-22(14-25(15)41(38,39)40)31-21-8-5-18(6-9-21)26(19-10-16(2)27(32)23(12-19)29(34)35)20-11-17(3)28(33)24(13-20)30(36)37;/h4-14,31-32H,1-3H3,(H,34,35)(H,36,37)(H,38,39,40);/q;+1/p-1/b26-20+; |
| InChIKey | QZAZWGJBHYORBY-ZFUDNRMFSA-M |
| Mol Weight | 597.56976928 g/mol |
| Molecular Formula | C30H24NNaO9S |
| Exact Mass | 597.106947 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | 26bHjXwsLhu |
|---|---|
| Name | Sodium 5-({4-[(3-carboxy-4-hydroxy-5-methylphenyl)(3-carboxy-5-methyl-4-oxo-2,5-cyclohexadien-1-ylidene)methyl]phenyl}amino)-2-methylbenzenesulfonate |
| Copyright | Copyright © 1989, 1990-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C30H24NNaO9S |
| InChI | InChI=1S/C30H25NO9S.Na/c1-15-4-7-22(14-25(15)41(38,39)40)31-21-8-5-18(6-9-21)26(19-10-16(2)27(32)23(12-19)29(34)35)20-11-17(3)28(33)24(13-20)30(36)37;/h4-14,31-32H,1-3H3,(H,34,35)(H,36,37)(H,38,39,40);/q;+1/p-1/b26-20+; |
| InChIKey | QZAZWGJBHYORBY-ZFUDNRMFSA-M |
| Instrument Name | Bruker IFS 85 |
| Technique | KBr-Pellet |