SpectraBase Compound ID | 7DuTvAu0aeh |
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InChI | InChI=1S/C18H14ClN3O8S2.2Na/c1-9(23)20-11-2-4-12(5-3-11)21-22-17-15(32(28,29)30)7-10-6-13(31(25,26)27)8-14(19)16(10)18(17)24;;/h2-8,24H,1H3,(H,20,23)(H,25,26,27)(H,28,29,30);;/q;2*+1/p-2/b22-21+;; |
InChIKey | HSOXKNDKUVHGOT-ZPZFBZIMSA-L |
Mol Weight | 543.85953856 g/mol |
Molecular Formula | C18H12ClN3Na2O8S2 |
Exact Mass | 542.954973 g/mol |
SpectraBase Spectrum ID | FVnxSmvhL1J |
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Name | 2,7-Naphthalenedisulfonic acid, 3-[[4-(acetylamino)phenyl]azo]-5-chloro-4-hydroxy-, disodium salt |
CAS Registry Number | 5850-72-6 |
Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula | C18H12ClN3Na2O8S2 |
InChI | InChI=1S/C18H14ClN3O8S2.2Na/c1-9(23)20-11-2-4-12(5-3-11)21-22-17-15(32(28,29)30)7-10-6-13(31(25,26)27)8-14(19)16(10)18(17)24;;/h2-8,24H,1H3,(H,20,23)(H,25,26,27)(H,28,29,30);;/q;2*+1/p-2/b22-21+;; |
InChIKey | HSOXKNDKUVHGOT-ZPZFBZIMSA-L |
Instrument Name | Bruker IFS 85 |
Technique | KBr-Pellet |