Analyte Name

1-(Cyano-(4-methoxyphenyl)ethyl)cyclohexanol-d11

Molecular Formula

C15 D11 H8 N O2

Molecular Weight

256.385

Accurate Mass

256.211

SMILES

[2H]C(C#N)(c1ccc(OC)cc1)C2(O)C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C2([2H])[2H]

InChI

InChI=1S/C15H19NO2/c1-18-13-7-5-12(6-8-13)14(11-16)15(17)9-3-2-4-10-15/h5-8,14,17H,2-4,9-10H2,1H3/i2D2,3D2,4D2,9D2,10D2,14D

IUPAC

2-(2,2,3,3,4,4,5,5,6,6-decadeuterio-1-hydroxycyclohexyl)-2-deuterio-2-(4-methoxyphenyl)acetonitrile

Unlabelled CAS Number

102691-36-1

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat