CID 93010

1,2-dibromo-1,2-diphenylethane

Structural Information

Molecular Formula
C14H12Br2
SMILES
C1=CC=C(C=C1)C(C(C2=CC=CC=C2)Br)Br
InChI
InChI=1S/C14H12Br2/c15-13(11-7-3-1-4-8-11)14(16)12-9-5-2-6-10-12/h1-10,13-14H
InChIKey
GKESIQQTGWVOLH-UHFFFAOYSA-N
Compound name
(1,2-dibromo-2-phenylethyl)benzene
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

3
References

168
Patents

337.93057 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 338.93785 153.7
[M+Na]+ 360.91979 149.9
[M+NH4]+ 355.96439 156.5
[M+K]+ 376.89373 155.2
[M-H]- 336.92329 156.2
[M+Na-2H]- 358.90524 157.5
[M]+ 337.93002 152.9
[M]- 337.93112 152.9
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