SpectraBase Compound ID | BoS7lzb3Xdn |
---|---|
InChI | InChI=1S/C23H16N6O9S.2Na/c24-15-7-6-12-14(20(15)27-25-16-4-2-1-3-13(16)23(32)33)10-19(39(36,37)38)21(22(12)31)28-26-17-9-11(29(34)35)5-8-18(17)30;;/h1-10,30-31H,24H2,(H,32,33)(H,36,37,38);;/q;2*+1/p-2/b27-25?,28-26+;; |
InChIKey | FVIOAFUVWNSVJR-FRWIFBIHSA-L |
Mol Weight | 596.43753856 g/mol |
Molecular Formula | C23H14N6Na2O9S |
Exact Mass | 596.033836 g/mol |
SpectraBase Spectrum ID | L8sfPybZEto |
---|---|
Name | Benzoic acid, 2-[[2-amino-5-hydroxy-6-[(2-hydroxy-5-nitrophenyl)azo]-7-sulfo-1-naphthalenyl]azo]-, disodium salt |
CAS Registry Number | 5850-21-5 |
Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula | C23H14N6Na2O9S |
InChI | InChI=1S/C23H16N6O9S.2Na/c24-15-7-6-12-14(20(15)27-25-16-4-2-1-3-13(16)23(32)33)10-19(39(36,37)38)21(22(12)31)28-26-17-9-11(29(34)35)5-8-18(17)30;;/h1-10,30-31H,24H2,(H,32,33)(H,36,37,38);;/q;2*+1/p-2/b27-25?,28-26+;; |
InChIKey | FVIOAFUVWNSVJR-FRWIFBIHSA-L |
Instrument Name | Bruker IFS 85 |
Technique | KBr-Pellet |