![Sodium 2-ethoxy-4-({4-[{4-[(4-ethoxy-3-sulfonatophenyl)iminio]-2,5-cyclohexadien-1-ylidene}(1-methyl-2-phenyl-1H-indol-3-yl)methyl]phenyl}amino)benzenesulfonate](/api/spectrum/1c8GGxPzkn2/structure.png?h=300&w=458 "Sodium 2-ethoxy-4-({4-[{4-[(4-ethoxy-3-sulfonatophenyl)iminio]-2,5-cyclohexadien-1-ylidene}(1-methyl-2-phenyl-1H-indol-3-yl)methyl]phenyl}amino)benzenesulfonate")
| SpectraBase Compound ID | 5jXFrwKlPe5 |
|---|---|
| InChI | InChI=1S/C44H39N3O8S2.Na/c1-4-54-38-25-23-35(28-41(38)57(51,52)53)46-33-21-17-30(18-22-33)42(43-36-13-9-10-14-37(36)47(3)44(43)31-11-7-6-8-12-31)29-15-19-32(20-16-29)45-34-24-26-40(56(48,49)50)39(27-34)55-5-2;/h6-28,45H,4-5H2,1-3H3,(H,48,49,50)(H,51,52,53);/q;+1/p-1/b42-30-,46-33-; |
| InChIKey | ZAHKTFZIPSBZHG-JPLUQQARSA-M |
| Mol Weight | 823.91076928 g/mol |
| Molecular Formula | C44H38N3NaO8S2 |
| Exact Mass | 823.199802 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | 1c8GGxPzkn2 |
|---|---|
| Name | Sodium 2-ethoxy-4-({4-[{4-[(4-ethoxy-3-sulfonatophenyl)iminio]-2,5-cyclohexadien-1-ylidene}(1-methyl-2-phenyl-1H-indol-3-yl)methyl]phenyl}amino)benzenesulfonate |
| Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C44H38N3NaO8S2 |
| InChI | InChI=1S/C44H39N3O8S2.Na/c1-4-54-38-25-23-35(28-41(38)57(51,52)53)46-33-21-17-30(18-22-33)42(43-36-13-9-10-14-37(36)47(3)44(43)31-11-7-6-8-12-31)29-15-19-32(20-16-29)45-34-24-26-40(56(48,49)50)39(27-34)55-5-2;/h6-28,45H,4-5H2,1-3H3,(H,48,49,50)(H,51,52,53);/q;+1/p-1/b42-30-,46-33-; |
| InChIKey | ZAHKTFZIPSBZHG-JPLUQQARSA-M |
| Instrument Name | Bruker IFS 85 |
| Technique | KBr-Pellet |