Analyte Name

(1R,2R,3R)-2-(2,6-Dimethoxy-4-pentylphenyl)-6-methylene-3-(1-methylethenyl)cyclohexanol-D9 1-Acetate

Molecular Formula

C25 D9 H27 O4

Molecular Weight

409.606

Accurate Mass

409.318

SMILES

[2H]C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])Cc1cc(OC)c([C@@H]2[C@H](CCC(=C)C2OC(=O)C)C(=C)C)c(OC)c1

InChI

InChI=1S/C25H36O4/c1-8-9-10-11-19-14-21(27-6)24(22(15-19)28-7)23-20(16(2)3)13-12-17(4)25(23)29-18(5)26/h14-15,20,23,25H,2,4,8-13H2,1,3,5-7H3/t20-,23+,25?/m1/s1/i1D3,8D2,9D2,10D2

IUPAC

[(2S,3S)-2-[2,6-dimethoxy-4-(2,2,3,3,4,4,5,5,5-nonadeuteriopentyl)phenyl]-6-methylidene-3-prop-1-en-2-ylcyclohexyl] acetate

Unlabelled CAS Number

306734-01-0

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat