CID 117535810

1-bromo-1-(2-bromophenyl)propan-2-one

Structural Information

Molecular Formula
C9H8Br2O
SMILES
CC(=O)C(C1=CC=CC=C1Br)Br
InChI
InChI=1S/C9H8Br2O/c1-6(12)9(11)7-4-2-3-5-8(7)10/h2-5,9H,1H3
InChIKey
OEYYUPATHDKOPH-UHFFFAOYSA-N
Compound name
1-bromo-1-(2-bromophenyl)propan-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

289.8942 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 290.90148 143.5
[M+Na]+ 312.88342 138.6
[M+NH4]+ 307.92802 145.6
[M+K]+ 328.85736 145.3
[M-H]- 288.88692 144.2
[M+Na-2H]- 310.86887 145.4
[M]+ 289.89365 141.9
[M]- 289.89475 141.9
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.