SpectraBase Compound ID | 6cNQGqND0uw |
---|---|
InChI | InChI=1S/C21H15N5O8S2.2Na/c27-20-15-3-1-2-4-16(15)22-21(28)19(20)26-25-17-10-7-13(11-18(17)36(32,33)34)24-23-12-5-8-14(9-6-12)35(29,30)31;;/h1-11H,(H2,22,27,28)(H,29,30,31)(H,32,33,34);;/q;2*+1/p-2/b24-23-,26-25+;; |
InChIKey | JDDVHIBLWXYUSY-PWUBPIFUSA-L |
Mol Weight | 573.46153856 g/mol |
Molecular Formula | C21H13N5Na2O8S2 |
Exact Mass | 573.000093 g/mol |
SpectraBase Spectrum ID | D56LNyAQtmy |
---|---|
Name | Benzenesulfonic acid, 2-[(1,2-dihydro-4-hydroxy-2-oxo-3-quinolinyl)azo]-5-[(4-sulfophenyl)azo]-, disodium salt |
CAS Registry Number | 5905-29-3 |
Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula | C21H13N5Na2O8S2 |
InChI | InChI=1S/C21H15N5O8S2.2Na/c27-20-15-3-1-2-4-16(15)22-21(28)19(20)26-25-17-10-7-13(11-18(17)36(32,33)34)24-23-12-5-8-14(9-6-12)35(29,30)31;;/h1-11H,(H2,22,27,28)(H,29,30,31)(H,32,33,34);;/q;2*+1/p-2/b24-23-,26-25+;; |
InChIKey | JDDVHIBLWXYUSY-PWUBPIFUSA-L |
Instrument Name | Bruker IFS 85 |
Technique | KBr-Pellet |