CID 13714

13700-82-8

Structural Information

Molecular Formula
C14H10Cl2
SMILES
C1=CC=C(C=C1)C(=C(C2=CC=CC=C2)Cl)Cl
InChI
InChI=1S/C14H10Cl2/c15-13(11-7-3-1-4-8-11)14(16)12-9-5-2-6-10-12/h1-10H
InChIKey
FTIHFTVXYNBUSM-UHFFFAOYSA-N
Compound name
(1,2-dichloro-2-phenylethenyl)benzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

121
Patents

248.01596 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 249.02324 151.3
[M+Na]+ 271.00518 159.1
[M-H]- 247.00868 156.7
[M+NH4]+ 266.04978 169.3
[M+K]+ 286.97912 152.1
[M+H-H2O]+ 231.01322 145.7
[M+HCOO]- 293.01416 164.2
[M+CH3COO]- 307.02981 163.3
[M+Na-2H]- 268.99063 155.8
[M]+ 248.01541 152.0
[M]- 248.01651 152.0
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