SpectraBase Compound ID | C8CnxFFrYll |
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InChI | InChI=1S/C34H27N9O9S2.2Na/c1-18-12-30(42-41-29-16-31(43(44)45)25(36)15-24(29)35)32(52-2)17-28(18)40-39-27-11-10-26(20-6-3-4-7-21(20)27)38-37-19-13-23-22(34(14-19)54(49,50)51)8-5-9-33(23)53(46,47)48;;/h3-17H,35-36H2,1-2H3,(H,46,47,48)(H,49,50,51);;/q;2*+1/p-2/b38-37?,40-39+,42-41+;; |
InChIKey | UPMWRIVRZYQKQF-BXQFIDPGSA-L |
Mol Weight | 813.72753856 g/mol |
Molecular Formula | C34H25N9Na2O9S2 |
Exact Mass | 813.101204 g/mol |
SpectraBase Spectrum ID | KqCUc8IhqMj |
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Name | 1,5-Naphthalenedisulfonic acid, 3-[[4-[[4-[(2,4-diamino-5-nitrophenyl)azo]-5-methoxy-2-methylphenyl]azo]-1-naphthalenyl]azo]-, disodium salt |
CAS Registry Number | 6661-42-3 |
Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula | C34H25N9Na2O9S2 |
InChI | InChI=1S/C34H27N9O9S2.2Na/c1-18-12-30(42-41-29-16-31(43(44)45)25(36)15-24(29)35)32(52-2)17-28(18)40-39-27-11-10-26(20-6-3-4-7-21(20)27)38-37-19-13-23-22(34(14-19)54(49,50)51)8-5-9-33(23)53(46,47)48;;/h3-17H,35-36H2,1-2H3,(H,46,47,48)(H,49,50,51);;/q;2*+1/p-2/b38-37?,40-39+,42-41+;; |
InChIKey | UPMWRIVRZYQKQF-BXQFIDPGSA-L |
Instrument Name | Bruker IFS 85 |
Technique | KBr-Pellet |