Analyte Name

3-Ethyl Haloperidol Decanoate-d19

Molecular Formula

C33 D19 H26 Cl F N O3

Molecular Weight

577.284

Accurate Mass

576.426

SMILES

[2H]C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C(=O)OC1(CCN(CCCC(=O)c2ccc(F)c(CC)c2)CC1)c3ccc(Cl)cc3

InChI

InChI=1S/C33H45ClFNO3/c1-3-5-6-7-8-9-10-13-32(38)39-33(28-15-17-29(34)18-16-28)20-23-36(24-21-33)22-11-12-31(37)27-14-19-30(35)26(4-2)25-27/h14-19,25H,3-13,20-24H2,1-2H3/i1D3,3D2,5D2,6D2,7D2,8D2,9D2,10D2,13D2

IUPAC

[4-(4-chlorophenyl)-1-[4-(3-ethyl-4-fluorophenyl)-4-oxobutyl]piperidin-4-yl] 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-nonadecadeuteriodecanoate

Unlabelled CAS Number

1797982-02-5

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat