Analyte Name

Fenticonazole Impurity E

CAS Number

1313397-06-6

Molecular Formula

C37 H31 Cl2 N2 O S2 . N O3

Molecular Weight

716.70

Accurate Mass

715.1133

SMILES

[O-][N+](=O)[O-].Clc1ccc(C(Cn2cc[n+](Cc3ccc(Sc4ccccc4)cc3)c2)OCc5ccc(Sc6ccccc6)cc5)c(Cl)c1

InChI

InChI=1S/C37H31Cl2N2OS2.NO3/c38-30-15-20-35(36(39)23-30)37(42-26-29-13-18-34(19-14-29)44-32-9-5-2-6-10-32)25-41-22-21-40(27-41)24-28-11-16-33(17-12-28)43-31-7-3-1-4-8-31;2-1(3)4/h1-23,27,37H,24-26H2;/q+1;-1

IUPAC

1-[2-(2,4-dichlorophenyl)-2-[(4-phenylsulfanylphenyl)methoxy]ethyl]-3-[(4-phenylsulfanylphenyl)methyl]imidazol-3-ium;nitrate

Storage Temperature

2-8C Fridge/Coldroom

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Tariff Code

29332990