Product Code

TRC-N199992

CAS Number

1246820-24-5

Product Format

Neat

Molecular Formula

C24H30D6O3

Molecular Weight

378.58

Product Categories

Additional Neuro Products, TRC, Stable isotopes, Impurity Reference Materials

Product Type

Impurity, Stable Isotope Labelled

Unlabelled CAS Number

56469-15-9

Price and availability

48-hour USA dispatch time

Freight restricted.

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Product Information

Chemical Data

Analyte Name

cis-Nabilone-d6

CAS Number

1246820-24-5

Molecular Formula

C24H30D6O3

Molecular Weight

378.58

Accurate Mass

378.3041

SMILES

[2H]C([2H])([2H])C1(Oc2cc(cc(O)c2[C@@H]3CC(=O)CC[C@H]13)C(C)(C)CCCCCC)C([2H])([2H])[2H]

InChI

InChI=1S/C24H36O3/c1-6-7-8-9-12-23(2,3)16-13-20(26)22-18-15-17(25)10-11-19(18)24(4,5)27-21(22)14-16/h13-14,18-19,26H,6-12,15H2,1-5H3/t18-,19+/m1/s1/i4D3,5D3

IUPAC

(6aS,10aR)-1-hydroxy-3-(2-methyloctan-2-yl)-6,6-bis(trideuteriomethyl)-7,8,10,10a-tetrahydro-6aH-benzo[c]chromen-9-one

Unlabelled CAS Number

56469-15-9

SIL Type

Deuterium

Product Data

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

Product Description

An inactive isomer of Nabilone, present often as an impurity in labelled trans-Nabilone preparations.

References: Rubin, A., et al.: Clin. Pharmacol. Ther., 22, 85 (1977), Stark, P., et al.: J. Pharmacol. Exp. Ther., 214, 124 (1980), Souter, R.W., et al.: Anal. Profiles Drug Subs., 10, 499 (1981), Ward, A., Drugs, 30, 127 (1985),

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