CID 3341242

1,1-dibromo-2,2-diphenylethylene

Structural Information

Molecular Formula
C14H10Br2
SMILES
C1=CC=C(C=C1)C(=C(Br)Br)C2=CC=CC=C2
InChI
InChI=1S/C14H10Br2/c15-14(16)13(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H
InChIKey
CTBKMYSHGIZTQX-UHFFFAOYSA-N
Compound name
(2,2-dibromo-1-phenylethenyl)benzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

14
Patents

335.91492 Da
Monoisotopic Mass

5.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 336.92220 155.7
[M+Na]+ 358.90414 164.3
[M-H]- 334.90764 164.3
[M+NH4]+ 353.94874 173.1
[M+K]+ 374.87808 148.8
[M+H-H2O]+ 318.91218 163.8
[M+HCOO]- 380.91312 170.7
[M+CH3COO]- 394.92877 208.2
[M+Na-2H]- 356.88959 161.6
[M]+ 335.91437 187.5
[M]- 335.91547 187.5
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