Analyte Name

2-Amino-2-(4-octylphenethyl)propane-1,3-diyl Diacetate Hydrochloride

Molecular Formula

C23H37NO4.C2HF3O2

Molecular Weight

505.58

Accurate Mass

505.27

SMILES

CCCCCCCCC1=CC=C(CCC(N)(COC(C)=O)COC(C)=O)C=C1.O=C(C(F)(F)F)O

InChI

InChI=1S/C23H37NO4.C2HF3O2/c1-4-5-6-7-8-9-10-21-11-13-22(14-12-21)15-16-23(24,17-27-19(2)25)18-28-20(3)26;3-2(4,5)1(6)7/h11-14H,4-10,15-18,24H2,1-3H3;(H,6,7)

IUPAC

2-Amino-2-(4-octylphenethyl)propane-1,3-diyl diacetate 2,2,2-trifluoroacetate

Country of Origin

CANADA

Product Format

Neat