CID 246598

O,p'-dde

Structural Information

Molecular Formula
C14H8Cl4
SMILES
C1=CC=C(C(=C1)C(=C(Cl)Cl)C2=CC=C(C=C2)Cl)Cl
InChI
InChI=1S/C14H8Cl4/c15-10-7-5-9(6-8-10)13(14(17)18)11-3-1-2-4-12(11)16/h1-8H
InChIKey
ZDYJWDIWLRZXDB-UHFFFAOYSA-N
Compound name
1-chloro-2-[2,2-dichloro-1-(4-chlorophenyl)ethenyl]benzene
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

60
References

36
Patents

315.93802 Da
Monoisotopic Mass

7.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 316.94530 169.2
[M+Na]+ 338.92724 186.0
[M+NH4]+ 333.97184 178.7
[M+K]+ 354.90118 175.5
[M-H]- 314.93074 173.2
[M+Na-2H]- 336.91269 178.0
[M]+ 315.93747 174.1
[M]- 315.93857 174.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe