Analyte Name

4-[4-[4-(Hydroxydiphenylmethyl)-1-piperidinyl]-1-butyn-1-yl]-alpha,alpha-dimethyl-benzeneacetic Acid-d6

Molecular Formula

C32 D6 H29 N O3

Molecular Weight

487.662

Accurate Mass

487.299

SMILES

[2H]C([2H])([2H])C(C(=O)O)(c1ccc(cc1)C#CCCN2CCC(CC2)C(O)(c3ccccc3)c4ccccc4)C([2H])([2H])[2H]

InChI

InChI=1S/C32H35NO3/c1-31(2,30(34)35)26-18-16-25(17-19-26)11-9-10-22-33-23-20-29(21-24-33)32(36,27-12-5-3-6-13-27)28-14-7-4-8-15-28/h3-8,12-19,29,36H,10,20-24H2,1-2H3,(H,34,35)/i1D3,2D3

IUPAC

3,3,3-trideuterio-2-[4-[4-[4-[hydroxy(diphenyl)methyl]piperidin-1-yl]but-1-ynyl]phenyl]-2-(trideuteriomethyl)propanoic acid

Unlabelled CAS Number

832088-68-3

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat