SpectraBase Compound ID | 5lkn9BUAfl3 |
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InChI | InChI=1S/C34H27N5O10S2.2Na/c1-48-28-14-18(10-12-25(28)36-38-27-17-30(50(42,43)44)20-6-3-4-7-21(20)33(27)40)19-11-13-26(29(15-19)49-2)37-39-32-31(51(45,46)47)16-23-22(34(32)41)8-5-9-24(23)35;;/h3-17,40-41H,35H2,1-2H3,(H,42,43,44)(H,45,46,47);;/q;2*+1/p-2/b38-36+,39-37+;; |
InChIKey | OLYMHWJEOMQVJM-PYIFGEPISA-L |
Mol Weight | 773.69853856 g/mol |
Molecular Formula | C34H25N5Na2O10S2 |
Exact Mass | 773.083823 g/mol |
SpectraBase Spectrum ID | 9SOaKZ0gJxI |
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Name | 1-Naphthalenesulfonic acid, 3-[[4'-[(5-amino-1-hydroxy-3-sulfo-2-naphthalenyl)azo]-3,3'-dimethoxy[1,1'-biphenyl]-4-yl]azo]-4-hydroxy-, disodium salt |
CAS Registry Number | 6428-97-3 |
Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula | C34H25N5Na2O10S2 |
InChI | InChI=1S/C34H27N5O10S2.2Na/c1-48-28-14-18(10-12-25(28)36-38-27-17-30(50(42,43)44)20-6-3-4-7-21(20)33(27)40)19-11-13-26(29(15-19)49-2)37-39-32-31(51(45,46)47)16-23-22(34(32)41)8-5-9-24(23)35;;/h3-17,40-41H,35H2,1-2H3,(H,42,43,44)(H,45,46,47);;/q;2*+1/p-2/b38-36+,39-37+;; |
InChIKey | OLYMHWJEOMQVJM-PYIFGEPISA-L |
Instrument Name | Bruker IFS 85 |
Technique | KBr-Pellet |