The Acetylcholine-D9 bromide with CAS registry number of 93449-32-2 is also known as Ethanaminium, 2-(acetyloxy)-N,N,N-tri(methyl-D3)-, bromide (1:1). The systematic name is 2-Acetoxyethyl-tris(trideuteriomethyl)ammonium bromide. It belongs to product categories of Intermediates & Fine Chemicals; Isotope Labeled Compounds; Pharmaceuticals. In addition, the formula is C7H7BrD9NO2 and the molecular weight is 235.17. This chemical is a crystalline solid and it is used as a cholinergic.
You can still convert the following datas into molecular structure:
(1)SMILES:[2H]C([2H])([2H])[N+](CCOC(=O)C)(C([2H])([2H])[2H])C([2H])([2H])[2H].[Br-];
(2)InChI:InChI=1S/C7H16NO2.BrH/c1-7(9)10-6-5-8(2,3)4;/h5-6H2,1-4H3;1H/q+1;/p-1/i2D3,3D3,4D3;
(3)InChIKey:ZEHGKSPCAMLJDC-WWMMTMLWSA-M;
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