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Product Code

TRC-I872652

CAS Number

1217523-45-9

Product Format

Neat

Molecular Formula

C22H27D6N5

Molecular Weight

373.57

Product Categories

TRC, Stable isotopes

Alternate CAS Number

[376348-71-9

Unlabelled CAS Number

376348-71-9

Price and availability

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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

(1S)-3-[3-((3-Isopropyl-d6)-5-methyl-4H-1,2,4-triazol-4-yl)-exo-8-azabicyclo[3.2.1]oct-8-yl]-1-phenyl-1-propanamine

CAS Number

1217523-45-9

Molecular Formula

C22H27D6N5

Molecular Weight

373.57

Accurate Mass

373.3113

SMILES

[2H]C([2H])([2H])C(c1nnc(C)n1C2CC3CCC(C2)N3CC[C@H](N)c4ccccc4)C([2H])([2H])[2H]

InChI

InChI=1S/C22H33N5/c1-15(2)22-25-24-16(3)27(22)20-13-18-9-10-19(14-20)26(18)12-11-21(23)17-7-5-4-6-8-17/h4-8,15,18-21H,9-14,23H2,1-3H3/t18?,19?,20?,21-/m0/s1/i1D3,2D3

IUPAC

(1S)-3-[3-[3-(1,1,1,3,3,3-hexadeuteriopropan-2-yl)-5-methyl-1,2,4-triazol-4-yl]-8-azabicyclo[3.2.1]octan-8-yl]-1-phenylpropan-1-amine

Alternate CAS Number

[376348-71-9

Unlabelled CAS Number

376348-71-9

SIL Type

Deuterium

Product Data

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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