Mordant Blue 29
Product Name
Mordant Blue 29
CAS1667-99-8
MFC23H13Cl2Na3O9S
MW605.28
InChIInChI=1S/C23H16Cl2O9S.3Na/c1-9-5-11(7-13(20(9)26)22(28)29)17(12-6-10(2)21(27)14(8-12)23(30)31)18-15(24)3-4-16(19(18)25)35(32,33)34;;;/h3-8,26H,1-2H3,(H,28,29)(H,30,31)(H,32,33,34);;;/q;3*+1/p-3/b17-12-;;;
InChIKeyFUIZKNBTOOKONL-NDOZRWCBSA-K
SmilesC(=C1/C=C(C(=O)C(C([O-])=O)=C/1)C)(/C1=CC(=C(O)C(C([O-])=O)=C1)C)\C1C(Cl)=CC=C(S([O-])(=O)=O)C=1Cl.[Na+].[Na+].[Na+]
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