CID 79047

2-bromopropionyl bromide

Structural Information

Molecular Formula
C3H4Br2O
SMILES
CC(C(=O)Br)Br
InChI
InChI=1S/C3H4Br2O/c1-2(4)3(5)6/h2H,1H3
InChIKey
ILLHORFDXDLILE-UHFFFAOYSA-N
Compound name
2-bromopropanoyl bromide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

3
References

2669
Patents

213.86288 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 214.87016 130.8
[M+Na]+ 236.85210 125.1
[M+NH4]+ 231.89670 132.8
[M+K]+ 252.82604 132.6
[M-H]- 212.85560 130.1
[M+Na-2H]- 234.83755 131.5
[M]+ 213.86233 128.6
[M]- 213.86343 128.6
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