| SpectraBase Compound ID | L5DlEKO6MRO |
|---|---|
| InChI | InChI=1S/C45H45N3O7S2.Na/c1-4-47(31-33-9-7-11-43(29-33)56(49,50)51)40-23-15-36(16-24-40)45(35-13-19-38(20-14-35)46-39-21-27-42(28-22-39)55-6-3)37-17-25-41(26-18-37)48(5-2)32-34-10-8-12-44(30-34)57(52,53)54;/h7-30H,4-6,31-32H2,1-3H3,(H2,49,50,51,52,53,54);/q;+1/p-1 |
| InChIKey | NKLPQNGYXWVELD-UHFFFAOYSA-M |
| Mol Weight | 825.97076928 g/mol |
| Molecular Formula | C45H44N3NaO7S2 |
| Exact Mass | 825.251837 g/mol |
Attenuated Total Reflectance Infrared (ATR-IR) Spectrum
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| SpectraBase Spectrum ID | Gmdye5LuqOL |
|---|---|
| Name | Brillant Blue R |
| Source of Sample | Sigma-Aldrich Inc. |
| Catalog Number | B-0630 |
| Accessory | DurasamplIR II |
| CAS Registry Number | 6104-59-2 |
| Compound Type | Pure |
| Copyright | Copyright © 2012-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C45H44N3NaO7S2 |
| InChI | InChI=1S/C45H45N3O7S2.Na/c1-4-47(31-33-9-7-11-43(29-33)56(49,50)51)40-23-15-36(16-24-40)45(35-13-19-38(20-14-35)46-39-21-27-42(28-22-39)55-6-3)37-17-25-41(26-18-37)48(5-2)32-34-10-8-12-44(30-34)57(52,53)54;/h7-30H,4-6,31-32H2,1-3H3,(H2,49,50,51,52,53,54);/q;+1/p-1 |
| InChIKey | NKLPQNGYXWVELD-UHFFFAOYSA-M |
| Instrument Name | Bio-Rad FTS |
| Source of Spectrum | Forensic Spectral Research |
| Synonyms | Coomassie Brilliant Blue R |
| Technique | ATR-Neat (DuraSamplIR II) |