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Product Code

TRC-T786347

CAS Number

1189981-17-6

Product Format

Neat

Molecular Formula

C21H15D3F4N2O2

Molecular Weight

409.39

Product Categories

TRC, Stable isotopes

Unlabelled CAS Number

1076199-46-6

Price and availability

48-hour USA dispatch time
Freight restricted.
If Exact Weight packaging is selected, a certificate will be delivered with the product, which will indicate the mass of the material dispensed into the vial with a precision of up to 3 decimal places. Exceptions apply.

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Product Information

Chemical Data

Analyte Name

N-Trifluoroacetodesmethyl Citalopram-d3

CAS Number

1189981-17-6

Molecular Formula

C21H15D3F4N2O2

Molecular Weight

409.39

Accurate Mass

409.1493

SMILES

[2H]C([2H])([2H])N(CCCC1(OCc2cc(ccc12)C#N)c3ccc(F)cc3)C(=O)C(F)(F)F

InChI

InChI=1S/C21H18F4N2O2/c1-27(19(28)21(23,24)25)10-2-9-20(16-4-6-17(22)7-5-16)18-8-3-14(12-26)11-15(18)13-29-20/h3-8,11H,2,9-10,13H2,1H3/i1D3

IUPAC

N-[3-[5-cyano-1-(4-fluorophenyl)-3H-2-benzofuran-1-yl]propyl]-2,2,2-trifluoro-N-(trideuteriomethyl)acetamide

Unlabelled CAS Number

1076199-46-6

SIL Type

Deuterium

Product Data

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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