Benzoyl Ecgonine Ethyl Ester-d8
Product Specifications
CAS Number
152521-09-0
Synonyms
Cocaethylene-D8; Benzoylethylecgonine-D8
Hazard Statement
Toxic if swallowed; UN number: UN2811; Packing Group: III
Purity
>95% (HPLC)
Smiles
[2H]C([2H])([2H])N1[C@H]2CC[C@@H]1[C@H]([C@H](C2)OC(=O)c3ccccc3)C(=O)OC([2H])([2H])C([2H])([2H])[2H]
Molecular Formula
C18 2H8 H15 N O4
Molecular Weight
325.43
InChI
InChI=1S/C18H23NO4/c1-3-22-18(21)16-14-10-9-13(19(14)2)11-15(16)23-17(20)12-7-5-4-6-8-12/h4-8,13-16H,3,9-11H2,1-2H3/t13-,14+,15-,16+/m0/s1/i1D3,2D3,3D2
Additionnal Information
IUPAC name: 1,1,2,2,2-pentadeuterioethyl (1S,3S,4R,5R)-3-benzoyloxy-8-(trideuteriomethyl)-8-azabicyclo[3.2.1]octane-4-carboxylate
Shipping Conditions
Room Temperature
Storage Conditions
-20°C
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