<-](/api/spectrum/4qCvCi0BKvu/structure.png?h=300&w=458 "(Salicylacid[-benzidine)-](gamma-acid->m-phenylendiamin)<-")
| SpectraBase Compound ID | L6JI6qLXeBA |
|---|---|
| InChI | InChI=1S/C54H38N12O10S.3Na/c55-44-27-45(56)47(28-46(44)64-59-36-14-5-31(6-15-36)29-1-10-34(11-2-29)57-61-39-19-21-48(67)42(25-39)53(70)71)65-63-38-18-9-33-23-50(77(74,75)76)51(52(69)41(33)24-38)66-60-37-16-7-32(8-17-37)30-3-12-35(13-4-30)58-62-40-20-22-49(68)43(26-40)54(72)73;;;/h1-28,67-69H,55-56H2,(H,70,71)(H,72,73)(H,74,75,76);;;/q;3*+1/p-3/b61-57?,62-58?,64-59?,65-63-,66-60?;;; |
| InChIKey | AAXYFBHVUXZFHD-BGJNGFQTSA-K |
| Mol Weight | 1112.97730785 g/mol |
| Molecular Formula | C54H35N12Na3O10S |
| Exact Mass | 1112.201289 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | 4qCvCi0BKvu |
|---|---|
| Name | (Salicylacid[-benzidine)-](gamma-acid->m-phenylendiamin)<- |
| Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C54H35N12Na3O10S |
| InChI | InChI=1S/C54H38N12O10S.3Na/c55-44-27-45(56)47(28-46(44)64-59-36-14-5-31(6-15-36)29-1-10-34(11-2-29)57-61-39-19-21-48(67)42(25-39)53(70)71)65-63-38-18-9-33-23-50(77(74,75)76)51(52(69)41(33)24-38)66-60-37-16-7-32(8-17-37)30-3-12-35(13-4-30)58-62-40-20-22-49(68)43(26-40)54(72)73;;;/h1-28,67-69H,55-56H2,(H,70,71)(H,72,73)(H,74,75,76);;;/q;3*+1/p-3/b61-57?,62-58?,64-59?,65-63-,66-60?;;; |
| InChIKey | AAXYFBHVUXZFHD-BGJNGFQTSA-K |
| Instrument Name | Bruker IFS 85 |
| Technique | KBr-Pellet |