Analyte Name

FeTPPS

CAS Number

90384-82-0

Molecular Formula

C44H30ClFeN4O12S4

Molecular Weight

1026.29

Accurate Mass

1024.98

SMILES

[Cl-][Fe+3]123[N-]4C5C(C6=CC=C(S(=O)([O-])=O)C=C6)=C7[N]1=C(C=C7)C(C8=CC=C(S(=O)([O-])=O)C=C8)=C9[N-]2C(C=C9)=C(C%10=CC=C(S(=O)([O-])=O)C=C%10)C%11=[N]3C(C=C%11)=C(C%12=CC=C(S(=O)([O-])=O)C=C%12)C4C=C5.[H+].[H+].[H+].[H+]

InChI

InChI=1S/C44H30N4O12S4.ClH.Fe/c49-61(50,51)29-9-1-25(2-10-29)41-33-17-19-35(45-33)42(26-3-11-30(12-4-26)62(52,53)54)37-21-23-39(47-37)44(28-7-15-32(16-8-28)64(58,59)60)40-24-22-38(48-40)43(36-20-18-34(41)46-36)27-5-13-31(14-6-27)63(55,56)57;;/h1-24,33,35H,(H,49,50,51)(H,52,53,54)(H,55,56,57)(H,58,59,60);1H;/q-2;;+3/p-1/b41-34-,42-37-,43-38-,44-40-;;

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat