茜素紫(6408-63-5)红外图谱(IR2)
分子式:C28H23N2NaO8S2
分子量: 602.61
InChI:InChI=1S/C28H22N2O8S2.2Na/c1-15-9-11-19(23(13-15)39(33,34)35)29-21-7-3-5-17-25(21)27(31)18-6-4-8-22(26(18)28(17)32)30-20-12-10-16(2)14-24(20)40(36,37)38;;/h3-14,29-30H,1-2H3,(H,33,34,35)(H,36,37,38);;/q;2*+1/p-2
InChIKey: FBNCDTLHQPLASV-UHFFFAOYSA-L
Smiles:C12C(=O)C3=C(C(=CC=C3)NC3C=CC(C)=CC=3S([O-])(=O)=O)C(=O)C1=CC=CC=2NC1C=CC(C)=CC=1S([O-])(=O)=O.[Na+].[Na+]