Product Code

TRC-A793507

Product Format

Neat

Molecular Formula

C22 D5 H12 Cl O3

Molecular Weight

369.852

Product Categories

TRC, Stable isotopes, Pharmaceutical Toxicology Reference Materials

Product Type

Stable Isotope Labelled

Unlabelled CAS Number

1809464-27-4

Price and availability

48-hour USA dispatch time

Freight restricted.

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Product Information

Chemical Data

Analyte Name

(±)-Atovaquone Impurity C-d5

Molecular Formula

C22 D5 H12 Cl O3

Molecular Weight

369.852

Accurate Mass

369.118

SMILES

[2H]C1([2H])CC(=CC([2H])([2H])C1([2H])C2=C(O)C(=O)c3ccccc3C2=O)c4ccc(Cl)cc4

InChI

InChI=1S/C22H17ClO3/c23-16-11-9-14(10-12-16)13-5-7-15(8-6-13)19-20(24)17-3-1-2-4-18(17)21(25)22(19)26/h1-5,9-12,15,26H,6-8H2/i7D2,8D2,15D

IUPAC

2-[4-(4-chlorophenyl)-1,2,2,6,6-pentadeuteriocyclohex-3-en-1-yl]-3-hydroxynaphthalene-1,4-dione

Unlabelled CAS Number

1809464-27-4

SIL Type

Deuterium

Product Data

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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(±)-Atovaquone Impurity C-d5

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