Analyte Name

(R)-2-(3-(Diisopropylamino)-1-phenylpropyl)-4-methylphenyl Isobutyrate Hydrogen Fumarate

CAS Number

1428856-56-7

Molecular Formula

C26H37NO2 • C4H4O4

Molecular Weight

511.65

Accurate Mass

511.29

SMILES

O=C(C(C)C)OC1=C([C@@H](C2=CC=CC=C2)CCN(C(C)C)C(C)C)C=C(C)C=C1.O=C(O)/C=C/C(O)=O

InChI

InChI=1S/C26H37NO2.C4H4O4/c1-18(2)26(28)29-25-14-13-21(7)17-24(25)23(22-11-9-8-10-12-22)15-16-27(19(3)4)20(5)6;5-3(6)1-2-4(7)8/h8-14,17-20,23H,15-16H2,1-7H3;1-2H,(H,5,6)(H,7,8)/b;2-1+/t23-;/m1./s1

IUPAC

(R)-2-(3-(diisopropylamino)-1-phenylpropyl)-4-methylphenyl isobutyrate fumarate

Alternate CAS Number

Free Base: 895137-81-2

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat