CID 8256

Tribromoacetaldehyde

Structural Information

Molecular Formula
C2HBr3O
SMILES
C(=O)C(Br)(Br)Br
InChI
InChI=1S/C2HBr3O/c3-2(4,5)1-6/h1H
InChIKey
YTGSYRVSBPFKMQ-UHFFFAOYSA-N
Compound name
2,2,2-tribromoacetaldehyde
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

9
References

2292
Patents

277.75775 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 278.76503 128.7
[M+Na]+ 300.74697 137.9
[M-H]- 276.75047 132.9
[M+NH4]+ 295.79157 145.5
[M+K]+ 316.72091 122.5
[M+H-H2O]+ 260.75501 144.0
[M+HCOO]- 322.75595 139.0
[M+CH3COO]- 336.77160 211.0
[M+Na-2H]- 298.73242 136.2
[M]+ 277.75720 169.0
[M]- 277.75830 169.0
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.