Cetalkonium Chloride-d7

Analyte Name

Cetalkonium Chloride-d7

CAS Number

1998128-85-0

Molecular Formula

C25 H39 D7 N . Cl

Molecular Weight

403.14

Accurate Mass

402.38

SMILES

C([N+](CCCCCCCCCCCCCCCC)(C)C)(C1=C(C(=C(C(=C1[2H])[2H])[2H])[2H])[2H])([2H])[2H].[Cl-]

InChI

InChI=1S/C25H46N.ClH/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-20-23-26(2,3)24-25-21-18-17-19-22-25;/h17-19,21-22H,4-16,20,23-24H2,1-3H3;1H/q+1;/p-1/i17D,18D,19D,21D,22D,24D2;

IUPAC

N,N-dimethyl-N-((phenyl-d5)methyl-d2)hexadecan-1-aminium chloride

Unlabelled CAS Number

122-18-9

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)