SpectraBase Compound ID | Bov6Loe8MXs |
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InChI | InChI=1S/C20H14N2O10S3.3Na/c23-20-18(35(30,31)32)10-11-9-12(33(24,25)26)5-6-13(11)19(20)22-21-16-7-8-17(34(27,28)29)15-4-2-1-3-14(15)16;;;/h1-10,23H,(H,24,25,26)(H,27,28,29)(H,30,31,32);;;/q;3*+1/p-3/b22-21+;;; |
InChIKey | WLDHEUZGFKACJH-ZRUFZDNISA-K |
Mol Weight | 604.46130785 g/mol |
Molecular Formula | C20H11N2Na3O10S3 |
Exact Mass | 603.926891 g/mol |
SpectraBase Spectrum ID | IqDMANqWB4p |
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Name | 2,7-Naphthalenedisulfonic acid, 3-hydroxy-4-[(4-sulfo-1-naphthalenyl)azo]-, trisodium salt |
CAS Registry Number | 642-59-1 |
Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula | C20H11N2Na3O10S3 |
InChI | InChI=1S/C20H14N2O10S3.3Na/c23-20-18(35(30,31)32)10-11-9-12(33(24,25)26)5-6-13(11)19(20)22-21-16-7-8-17(34(27,28)29)15-4-2-1-3-14(15)16;;;/h1-10,23H,(H,24,25,26)(H,27,28,29)(H,30,31,32);;;/q;3*+1/p-3/b22-21+;;; |
InChIKey | WLDHEUZGFKACJH-ZRUFZDNISA-K |
Instrument Name | Bruker IFS 85 |
Technique | KBr-Pellet |