| SpectraBase Compound ID | C7z9eaCmqbq |
|---|---|
| InChI | InChI=1S/C25H22N8O6S.Na/c26-19-12-20(27)24(40(37,38)39)13-22(19)33-31-17-6-2-4-15(10-17)29-25(36)28-14-3-1-5-16(9-14)30-32-21-8-7-18(34)11-23(21)35;/h1-13,34-35H,26-27H2,(H2,28,29,36)(H,37,38,39);/q;+1/p-1/b32-30-,33-31?; |
| InChIKey | TTWICBYDILFYDK-JTAJQNMZSA-M |
| Mol Weight | 584.54276928 g/mol |
| Molecular Formula | C25H21N8NaO6S |
| Exact Mass | 584.120246 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | GFt5JudkTR6 |
|---|---|
| Name | C.I.Direct Brown 148, monosodium salt |
| CAS Registry Number | 6391-25-9 |
| Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C25H21N8NaO6S |
| InChI | InChI=1S/C25H22N8O6S.Na/c26-19-12-20(27)24(40(37,38)39)13-22(19)33-31-17-6-2-4-15(10-17)29-25(36)28-14-3-1-5-16(9-14)30-32-21-8-7-18(34)11-23(21)35;/h1-13,34-35H,26-27H2,(H2,28,29,36)(H,37,38,39);/q;+1/p-1/b32-30-,33-31?; |
| InChIKey | TTWICBYDILFYDK-JTAJQNMZSA-M |
| Instrument Name | Bruker IFS 85 |
| Technique | KBr-Pellet |