![Methylium, bis[4-[ethyl[(3-sulfophenyl)methyl]amino]phenyl][4-ethylamino-3-methylphenyl]-, monosodium salt](/api/spectrum/LG7N7u6WSgd/structure.png?h=300&w=458 "Methylium, bis[4-[ethyl[(3-sulfophenyl)methyl]amino]phenyl][4-ethylamino-3-methylphenyl]-, monosodium salt")
| SpectraBase Compound ID | Gff6nJ12Aw7 |
|---|---|
| InChI | InChI=1S/C40H43N3O6S2.Na/c1-5-41-39-23-18-34(24-29(39)4)40(32-14-19-35(20-15-32)42(6-2)27-30-10-8-12-37(25-30)50(44,45)46)33-16-21-36(22-17-33)43(7-3)28-31-11-9-13-38(26-31)51(47,48)49;/h8-26H,5-7,27-28H2,1-4H3,(H2,44,45,46,47,48,49);/q;+1/p-1 |
| InChIKey | IZUTYEKZIBVITH-UHFFFAOYSA-M |
| Mol Weight | 747.90076928 g/mol |
| Molecular Formula | C40H42N3NaO6S2 |
| Exact Mass | 747.241273 g/mol |
Transmission Infrared (IR) Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | LG7N7u6WSgd |
|---|---|
| Name | Methylium, bis[4-[ethyl[(3-sulfophenyl)methyl]amino]phenyl][4-ethylamino-3-methylphenyl]-, monosodium salt |
| Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C40H42N3NaO6S2 |
| InChI | InChI=1S/C40H43N3O6S2.Na/c1-5-41-39-23-18-34(24-29(39)4)40(32-14-19-35(20-15-32)42(6-2)27-30-10-8-12-37(25-30)50(44,45)46)33-16-21-36(22-17-33)43(7-3)28-31-11-9-13-38(26-31)51(47,48)49;/h8-26H,5-7,27-28H2,1-4H3,(H2,44,45,46,47,48,49);/q;+1/p-1 |
| InChIKey | IZUTYEKZIBVITH-UHFFFAOYSA-M |
| Instrument Name | Bruker IFS 85 |
| Technique | KBr-Pellet |