CID 98491

1,1-bis(p-chlorophenyl)-2-chloroethene

Structural Information

Molecular Formula
C14H9Cl3
SMILES
C1=CC(=CC=C1C(=CCl)C2=CC=C(C=C2)Cl)Cl
InChI
InChI=1S/C14H9Cl3/c15-9-14(10-1-5-12(16)6-2-10)11-3-7-13(17)8-4-11/h1-9H
InChIKey
LNKQQZFLNUVWQQ-UHFFFAOYSA-N
Compound name
1-chloro-4-[2-chloro-1-(4-chlorophenyl)ethenyl]benzene
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

2319
References

489
Patents

281.977 Da
Monoisotopic Mass

6.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 282.98428 157.2
[M+Na]+ 304.96622 166.9
[M-H]- 280.96972 161.7
[M+NH4]+ 300.01082 174.3
[M+K]+ 320.94016 158.9
[M+H-H2O]+ 264.97426 152.2
[M+HCOO]- 326.97520 165.5
[M+CH3COO]- 340.99085 168.7
[M+Na-2H]- 302.95167 160.2
[M]+ 281.97645 159.4
[M]- 281.97755 159.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.