![Methylium, bis[4-[methyl[(3-sulfophenyl)methyl]amino]phenyl][4-(dimethylamino)phenyl]-, monosodium salt](/api/spectrum/K2bl2lwL0OR/structure.png?h=300&w=458 "Methylium, bis[4-[methyl[(3-sulfophenyl)methyl]amino]phenyl][4-(dimethylamino)phenyl]-, monosodium salt")
| SpectraBase Compound ID | 8bVs77z2F0j |
|---|---|
| InChI | InChI=1S/C37H37N3O6S2.Na/c1-38(2)32-17-11-29(12-18-32)37(30-13-19-33(20-14-30)39(3)25-27-7-5-9-35(23-27)47(41,42)43)31-15-21-34(22-16-31)40(4)26-28-8-6-10-36(24-28)48(44,45)46;/h5-24H,25-26H2,1-4H3,(H-,41,42,43,44,45,46);/q;+1/p-1 |
| InChIKey | ZEIFLBRADKFNSJ-UHFFFAOYSA-M |
| Mol Weight | 705.81976928 g/mol |
| Molecular Formula | C37H36N3NaO6S2 |
| Exact Mass | 705.194323 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | K2bl2lwL0OR |
|---|---|
| Name | Methylium, bis[4-[methyl[(3-sulfophenyl)methyl]amino]phenyl][4-(dimethylamino)phenyl]-, monosodium salt |
| Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C37H36N3NaO6S2 |
| InChI | InChI=1S/C37H37N3O6S2.Na/c1-38(2)32-17-11-29(12-18-32)37(30-13-19-33(20-14-30)39(3)25-27-7-5-9-35(23-27)47(41,42)43)31-15-21-34(22-16-31)40(4)26-28-8-6-10-36(24-28)48(44,45)46;/h5-24H,25-26H2,1-4H3,(H-,41,42,43,44,45,46);/q;+1/p-1 |
| InChIKey | ZEIFLBRADKFNSJ-UHFFFAOYSA-M |
| Instrument Name | Bruker IFS 85 |
| Technique | KBr-Pellet |