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Nitrotetrazolium blue chloride(298-83-9) 1H NMR
Product NameNitrotetrazolium blue chloride
CAS298-83-9
Molecular FormulaC40H30ClN10O6+
Molecular Weight782.19
InChIInChI=1S/C40H30N10O6.2ClH/c1-55-37-25-29(13-23-35(37)47-43-39(27-9-5-3-6-10-27)41-45(47)31-15-19-33(20-16-31)49(51)52)30-14-24-36(38(26-30)56-2)48-44-40(28-11-7-4-8-12-28)42-46(48)32-17-21-34(22-18-32)50(53)54;;/h3-26H,1-2H3;2*1H/q+2;;/p-2
InChIKey FSVCQIDHPKZJSO-UHFFFAOYSA-L
Smiles[N+]1(=NC(C2C=CC=CC=2)=NN1C1C=CC([N+]([O-])=O)=CC=1)C1C=CC(C2C=CC([N+]3=NC(C4C=CC=CC=4)=NN3C3=CC=C([N+]([O-])=O)C=C3)=C(OC)C=2)=CC=1OC.[Cl-].[Cl-]
