SpectraBase Compound ID | 1UCRfmwB6Ci |
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InChI | InChI=1S/C38H27N5O11S3.3Na/c44-37-31-16-14-29(39-26-4-2-1-3-5-26)18-24(31)20-33(56(49,50)51)35(37)42-40-27-10-6-22(7-11-27)23-8-12-28(13-9-23)41-43-36-34(57(52,53)54)21-25-19-30(55(46,47)48)15-17-32(25)38(36)45;;;/h1-21,39,44-45H,(H,46,47,48)(H,49,50,51)(H,52,53,54);;;/q;3*+1/p-3/b42-40+,43-41+;;; |
InChIKey | VHHCHZJJXIEHDS-VVVPJKEESA-K |
Mol Weight | 891.78330785 g/mol |
Molecular Formula | C38H24N5Na3O11S3 |
Exact Mass | 891.032753 g/mol |
SpectraBase Spectrum ID | 2vdcIFSccbf |
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Name | 1-Naphthol-3,6-disulfonic acid(1)[-benzidine-](2)(alk)N-phenyl-J=acid, trinatrium salt |
CAS Registry Number | 6426-65-9 |
Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula | C38H24N5Na3O11S3 |
InChI | InChI=1S/C38H27N5O11S3.3Na/c44-37-31-16-14-29(39-26-4-2-1-3-5-26)18-24(31)20-33(56(49,50)51)35(37)42-40-27-10-6-22(7-11-27)23-8-12-28(13-9-23)41-43-36-34(57(52,53)54)21-25-19-30(55(46,47)48)15-17-32(25)38(36)45;;;/h1-21,39,44-45H,(H,46,47,48)(H,49,50,51)(H,52,53,54);;;/q;3*+1/p-3/b42-40+,43-41+;;; |
InChIKey | VHHCHZJJXIEHDS-VVVPJKEESA-K |
Instrument Name | Bruker IFS 85 |
Synonyms | 2,7-Naphthalenedisulfonic acid, 4-hydroxy-3-[[4'-[[1-hydroxy-6-(phenylamino)-3-sulfo-2-naphthalenyl]azo][1,1'-biphenyl]-4-yl]azo]-, trisodium salt |
Technique | KBr-Pellet |