Analyte Name

True Blue Diaceturate Salt

CAS Number

108321-12-6

Molecular Formula

C20H16N4O2 • 2(C4H7NO3)

Molecular Weight

578.57

Accurate Mass

578.21

SMILES

O=C(O)CNC(C)=O.N=C(N)C1=CC2=C(C=C1)OC(C=CC3=CC4=C(O3)C=CC(C(N)=N)=C4)=C2.O=C(O)CNC(C)=O

InChI

InChI=1S/C20H16N4O2.2C4H7NO3/c21-19(22)11-1-5-17-13(7-11)9-15(25-17)3-4-16-10-14-8-12(20(23)24)2-6-18(14)26-16;2*1-3(6)5-2-4(7)8/h1-10H,(H3,21,22)(H3,23,24);2*2H2,1H3,(H,5,6)(H,7,8)

IUPAC

2,2'-(ethene-1,2-diyl)bis(benzofuran-5-carboximidamide) bis(acetylglycinate)

Alternate CAS Number

free acid: 65426-90-6

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat