![Acetoacetic acid, 2-[[2,2'-dichloro-4'-[(8-ethoxy-1-hydroxy-3,6-disulfo-2-naphthyl)azo]-4-biphenyl]azo-, ethyl ester, disodium salt](/api/spectrum/5tsIke4ZmMd/structure.png?h=300&w=458 "Acetoacetic acid, 2-[[2,2'-dichloro-4'-[(8-ethoxy-1-hydroxy-3,6-disulfo-2-naphthyl)azo]-4-biphenyl]azo-, ethyl ester, disodium salt")
| SpectraBase Compound ID | Dfk3wxbsxiL |
|---|---|
| InChI | InChI=1S/C30H26Cl2N4O11S2.2Na/c1-4-46-24-14-19(48(40,41)42)10-16-11-25(49(43,44)45)28(29(38)26(16)24)36-34-18-7-9-21(23(32)13-18)20-8-6-17(12-22(20)31)33-35-27(15(3)37)30(39)47-5-2;;/h6-14,37-38H,4-5H2,1-3H3,(H,40,41,42)(H,43,44,45);;/q;2*+1/p-2/b27-15-,35-33+,36-34+;; |
| InChIKey | INAAYPUFRSCILU-NUISHBHQSA-L |
| Mol Weight | 797.54453856 g/mol |
| Molecular Formula | C30H24Cl2N4Na2O11S2 |
| Exact Mass | 796.005544 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | 5tsIke4ZmMd |
|---|---|
| Name | Acetoacetic acid, 2-[[2,2'-dichloro-4'-[(8-ethoxy-1-hydroxy-3,6-disulfo-2-naphthyl)azo]-4-biphenyl]azo-, ethyl ester, disodium salt |
| CAS Registry Number | 6837-43-0 |
| Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C30H24Cl2N4Na2O11S2 |
| InChI | InChI=1S/C30H26Cl2N4O11S2.2Na/c1-4-46-24-14-19(48(40,41)42)10-16-11-25(49(43,44)45)28(29(38)26(16)24)36-34-18-7-9-21(23(32)13-18)20-8-6-17(12-22(20)31)33-35-27(15(3)37)30(39)47-5-2;;/h6-14,37-38H,4-5H2,1-3H3,(H,40,41,42)(H,43,44,45);;/q;2*+1/p-2/b27-15-,35-33+,36-34+;; |
| InChIKey | INAAYPUFRSCILU-NUISHBHQSA-L |
| Instrument Name | Bruker IFS 85 |
| Technique | KBr-Pellet |