SpectraBase Compound ID | JX1AvDK0NdM |
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InChI | InChI=1S/C35H27N7O10S2.2Na/c1-19(43)36-22-7-9-24(10-8-22)40-42-32-30(54(50,51)52)18-21-16-26(12-14-28(21)34(32)45)38-35(46)37-25-11-13-27-20(15-25)17-29(53(47,48)49)31(33(27)44)41-39-23-5-3-2-4-6-23;;/h2-18,44-45H,1H3,(H,36,43)(H2,37,38,46)(H,47,48,49)(H,50,51,52);;/q;2*+1/p-2/b41-39-,42-40?;; |
InChIKey | NLMHXPDMNXMQBY-SGXFZIGHSA-L |
Mol Weight | 813.72353856 g/mol |
Molecular Formula | C35H25N7Na2O10S2 |
Exact Mass | 813.089971 g/mol |
SpectraBase Spectrum ID | 1SRNIkYJHXu |
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Name | 2-Naphthalenesulfonic acid, 3-[[4-(acetylamino)phenyl]azo]-4-hydroxy-7-[[[[5-hydroxy-6-(phenylazo)-7-sulfo-2-naphthalenyl]amino]carbonyl]amino]-, disodium salt |
CAS Registry Number | 3441-14-3 |
Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula | C35H25N7Na2O10S2 |
InChI | InChI=1S/C35H27N7O10S2.2Na/c1-19(43)36-22-7-9-24(10-8-22)40-42-32-30(54(50,51)52)18-21-16-26(12-14-28(21)34(32)45)38-35(46)37-25-11-13-27-20(15-25)17-29(53(47,48)49)31(33(27)44)41-39-23-5-3-2-4-6-23;;/h2-18,44-45H,1H3,(H,36,43)(H2,37,38,46)(H,47,48,49)(H,50,51,52);;/q;2*+1/p-2/b41-39-,42-40?;; |
InChIKey | NLMHXPDMNXMQBY-SGXFZIGHSA-L |
Instrument Name | Bruker IFS 85 |
Technique | KBr-Pellet |