Phosphocholine-d9 Chloride Calcium Salt

Analyte Name

Phosphocholine-d9 Chloride Calcium Salt

CAS Number

344299-43-0

Molecular Formula

C5H4D9CaClNO4P

Molecular Weight

266.72

Accurate Mass

266.05

SMILES

O=P([O-])([O-])OCC[N+](C([2H])([2H])[2H])(C([2H])([2H])[2H])C([2H])([2H])[2H].[Ca+2].[Cl-]

InChI

InChI=1S/C5H14NO4P.Ca.ClH/c1-6(2,3)4-5-10-11(7,8)9;;/h4-5H2,1-3H3,(H-,7,8,9);;1H/q;+2;/p-2/i1D3,2D3,3D3;;

IUPAC

calcium 2-(tris(methyl-d3)ammonio)ethyl phosphate chloride

Unlabelled CAS Number

4826-71-5

SIL Type

Deuterium

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Stable Isotope Labelled

Product Format

Neat

Purity

>95% (HPLC)