SpectraBase Compound ID | KWSfAzCLgrc |
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InChI | InChI=1S/C34H28N6O9S3.3Na/c1-18-13-20(7-11-27(18)37-39-29-17-30(51(44,45)46)25-5-3-4-6-26(25)32(29)35)21-8-12-28(19(2)14-21)38-40-34-24-10-9-23(50(41,42)43)15-22(24)16-31(33(34)36)52(47,48)49;;;/h3-17H,35-36H2,1-2H3,(H,41,42,43)(H,44,45,46)(H,47,48,49);;;/q;3*+1/p-3/b39-37+,40-38?;;; |
InChIKey | SKTUUIOCVCQGJC-VBVMXPAESA-K |
Mol Weight | 826.75630785 g/mol |
Molecular Formula | C34H25N6Na3O9S3 |
Exact Mass | 826.053823 g/mol |
SpectraBase Spectrum ID | Lol7jFG8KGC |
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Name | 2,7-Naphthalenedisulfonic acid, 3-amino-4-[[4'-[(1-amino-4-sulfo-2-naphthalenyl)azo]-3,3'-dimethyl[1,1'-biphenyl]-4-yl]azo]-, trisodium salt |
CAS Registry Number | 5413-69-4 |
Copyright | Copyright © 1989, 1990-2025 Wiley-VCH GmbH. All Rights Reserved. |
Formula | C34H25N6Na3O9S3 |
InChI | InChI=1S/C34H28N6O9S3.3Na/c1-18-13-20(7-11-27(18)37-39-29-17-30(51(44,45)46)25-5-3-4-6-26(25)32(29)35)21-8-12-28(19(2)14-21)38-40-34-24-10-9-23(50(41,42)43)15-22(24)16-31(33(34)36)52(47,48)49;;;/h3-17H,35-36H2,1-2H3,(H,41,42,43)(H,44,45,46)(H,47,48,49);;;/q;3*+1/p-3/b39-37+,40-38?;;; |
InChIKey | SKTUUIOCVCQGJC-VBVMXPAESA-K |
Instrument Name | Bruker IFS 85 |
Technique | KBr-Pellet |