CID 101326

Ethane, 1,1-bis(4-chlorophenyl)-2,2-dibromo-

Structural Information

Molecular Formula
C14H10Br2Cl2
SMILES
C1=CC(=CC=C1C(C2=CC=C(C=C2)Cl)C(Br)Br)Cl
InChI
InChI=1S/C14H10Br2Cl2/c15-14(16)13(9-1-5-11(17)6-2-9)10-3-7-12(18)8-4-10/h1-8,13-14H
InChIKey
UUGCMANRBZHHGR-UHFFFAOYSA-N
Compound name
1-chloro-4-[2,2-dibromo-1-(4-chlorophenyl)ethyl]benzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

405.85263 Da
Monoisotopic Mass

6.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 406.85991 164.2
[M+Na]+ 428.84185 175.7
[M-H]- 404.84535 172.6
[M+NH4]+ 423.88645 181.1
[M+K]+ 444.81579 157.7
[M+H-H2O]+ 388.84989 173.0
[M+HCOO]- 450.85083 171.4
[M+CH3COO]- 464.86648 176.8
[M+Na-2H]- 426.82730 168.3
[M]+ 405.85208 199.3
[M]- 405.85318 199.3
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.