![1,3-Benzenedisulfonic acid, 4-[[4-(ethylamino)-3-methylphenyl][4-(ethylimino)-3-methyl-2,5-cyclohexadien-1-ylidene]methyl]-6-hydroxy-, monosodium salt](/api/spectrum/5GPIzuiDdAS/structure.png?h=300&w=458 "1,3-Benzenedisulfonic acid, 4-[[4-(ethylamino)-3-methylphenyl][4-(ethylimino)-3-methyl-2,5-cyclohexadien-1-ylidene]methyl]-6-hydroxy-, monosodium salt")
| SpectraBase Compound ID | 5dhCpni7rYQ |
|---|---|
| InChI | InChI=1S/C25H28N2O7S2.Na/c1-5-26-20-9-7-17(11-15(20)3)25(18-8-10-21(27-6-2)16(4)12-18)19-13-22(28)24(36(32,33)34)14-23(19)35(29,30)31;/h7-14,26,28H,5-6H2,1-4H3,(H,29,30,31)(H,32,33,34);/q;+1/p-1/b25-18-,27-21-; |
| InChIKey | ACZRDWVARWLTRG-NECYXHARSA-M |
| Mol Weight | 554.60776928 g/mol |
| Molecular Formula | C25H27N2NaO7S2 |
| Exact Mass | 554.115738 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | 5GPIzuiDdAS |
|---|---|
| Name | 1,3-Benzenedisulfonic acid, 4-[[4-(ethylamino)-3-methylphenyl][4-(ethylimino)-3-methyl-2,5-cyclohexadien-1-ylidene]methyl]-6-hydroxy-, monosodium salt |
| CAS Registry Number | 4463-44-9 |
| Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C25H27N2NaO7S2 |
| InChI | InChI=1S/C25H28N2O7S2.Na/c1-5-26-20-9-7-17(11-15(20)3)25(18-8-10-21(27-6-2)16(4)12-18)19-13-22(28)24(36(32,33)34)14-23(19)35(29,30)31;/h7-14,26,28H,5-6H2,1-4H3,(H,29,30,31)(H,32,33,34);/q;+1/p-1/b25-18-,27-21-; |
| InChIKey | ACZRDWVARWLTRG-NECYXHARSA-M |
| Instrument Name | Bruker IFS 85 |
| Technique | KBr-Pellet |