Analyte Name

4,4'-DDT 13C12

CAS Number

104215-84-1

Molecular Formula

13C12 C2 H9 Cl5

Molecular Weight

366.40

Measured Value

98.0 %

Accurate Mass

363.9549

Flash Point

18

SMILES

Cl[13c]1[13cH][13cH][13c]([13cH][13cH]1)C([13c]2[13cH][13cH][13c](Cl)[13cH][13cH]2)C(Cl)(Cl)Cl

InChI

InChI=1S/C14H9Cl5/c15-11-5-1-9(2-6-11)13(14(17,18)19)10-3-7-12(16)8-4-10/h1-8,13H/i1+1,2+1,3+1,4+1,5+1,6+1,7+1,8+1,9+1,10+1,11+1,12+1

IUPAC

1-chloro-4-[2,2,2-trichloro-1-(4-chloro(1,2,3,4,5,6-^{13}C_{6})cyclohexa-1,3,5-trien-1-yl)ethyl](1,2,3,4,5,6-^{13}C_{6})cyclohexa-1,3,5-triene

Unlabelled CAS Number

50-29-3

SIL Type

Carbon

Storage Temperature

+18°C

Shipping Temperature

Room Temperature

Country of Origin

UNITED STATES

Product Type

Stable Isotope Labelled

Product Format

Neat