CID 61147

Bromoacetyl bromide

Structural Information

Molecular Formula
C2H2Br2O
SMILES
C(C(=O)Br)Br
InChI
InChI=1S/C2H2Br2O/c3-1-2(4)5/h1H2
InChIKey
LSTRKXWIZZZYAS-UHFFFAOYSA-N
Compound name
2-bromoacetyl bromide
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

14
References

16420
Patents

199.84724 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 200.85452 118.7
[M+Na]+ 222.83646 130.3
[M-H]- 198.83996 123.3
[M+NH4]+ 217.88106 140.8
[M+K]+ 238.81040 115.9
[M+H-H2O]+ 182.84450 127.4
[M+HCOO]- 244.84544 135.3
[M+CH3COO]- 258.86109 189.2
[M+Na-2H]- 220.82191 127.4
[M]+ 199.84669 152.1
[M]- 199.84779 152.1
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.