![Disodium 5-{[4-(dimethylamino)phenyl][4-(dimethyliminio)-2,5-cyclohexadien-1-ylidene]methyl}-8-[(4-methyl-3-sulfonatophenyl)amino]-2-naphthalenesulfonate chloride](/api/spectrum/AtRyeTV01w8/structure.png?h=300&w=458 "Disodium 5-{[4-(dimethylamino)phenyl][4-(dimethyliminio)-2,5-cyclohexadien-1-ylidene]methyl}-8-[(4-methyl-3-sulfonatophenyl)amino]-2-naphthalenesulfonate chloride")
| SpectraBase Compound ID | 6mPl31BoxRK |
|---|---|
| InChI | InChI=1S/C34H33N3O6S2.ClH.2Na/c1-22-6-11-25(20-33(22)45(41,42)43)35-32-19-18-30(29-17-16-28(21-31(29)32)44(38,39)40)34(23-7-12-26(13-8-23)36(2)3)24-9-14-27(15-10-24)37(4)5;;;/h6-21H,1-5H3,(H2,38,39,40,41,42,43);1H;;/q;;2*+1/p-2 |
| InChIKey | HCUFKXAXTFVDDQ-UHFFFAOYSA-L |
| Mol Weight | 724.2 g/mol |
| Molecular Formula | C34H32ClN3Na2O6S2 |
| Exact Mass | 723.121644 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | AtRyeTV01w8 |
|---|---|
| Name | Disodium 5-{[4-(dimethylamino)phenyl][4-(dimethyliminio)-2,5-cyclohexadien-1-ylidene]methyl}-8-[(4-methyl-3-sulfonatophenyl)amino]-2-naphthalenesulfonate chloride |
| Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C34H32ClN3Na2O6S2 |
| InChI | InChI=1S/C34H33N3O6S2.ClH.2Na/c1-22-6-11-25(20-33(22)45(41,42)43)35-32-19-18-30(29-17-16-28(21-31(29)32)44(38,39)40)34(23-7-12-26(13-8-23)36(2)3)24-9-14-27(15-10-24)37(4)5;;;/h6-21H,1-5H3,(H2,38,39,40,41,42,43);1H;;/q;;2*+1/p-2 |
| InChIKey | HCUFKXAXTFVDDQ-UHFFFAOYSA-L |
| Instrument Name | Bruker IFS 85 |
| Technique | KBr-Pellet |