SpectraBase Compound ID | 8KX52ZTdapE |
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InChI | InChI=1S/C20H19N3O11S3.2Na/c1-12(24)21-15-3-2-13-10-18(36(28,29)30)19(20(25)17(13)11-15)23-22-14-4-6-16(7-5-14)35(26,27)9-8-34-37(31,32)33;;/h2-7,10-11,25H,8-9H2,1H3,(H,21,24)(H,28,29,30)(H,31,32,33);;/q;2*+1/p-2/b23-22+;; |
InChIKey | DHHGSXPASZBLGC-VPMNAVQSSA-L |
Mol Weight | 617.52553856 g/mol |
Molecular Formula | C20H17N3Na2O11S3 |
Exact Mass | 616.98206 g/mol |
SpectraBase Spectrum ID | 7SRU1PGYhkN |
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Name | 2-(p-Aminophenylsulfonyl)ethanol sulfate ester->N-acetyl-gamma-acid2-Naphthalenesulfonic acid, 6-(acetylamino)-4-hydroxy-3-[[4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]azo]-, disodium salt |
CAS Registry Number | 20262-58-2 |
Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula | C20H17N3Na2O11S3 |
InChI | InChI=1S/C20H19N3O11S3.2Na/c1-12(24)21-15-3-2-13-10-18(36(28,29)30)19(20(25)17(13)11-15)23-22-14-4-6-16(7-5-14)35(26,27)9-8-34-37(31,32)33;;/h2-7,10-11,25H,8-9H2,1H3,(H,21,24)(H,28,29,30)(H,31,32,33);;/q;2*+1/p-2/b23-22+;; |
InChIKey | DHHGSXPASZBLGC-VPMNAVQSSA-L |
Instrument Name | Bruker IFS 85 |
Technique | KBr-Pellet |