CID 61108

Bromofluoromethane

Structural Information

Molecular Formula
CH2BrF
SMILES
C(F)Br
InChI
InChI=1S/CH2BrF/c2-1-3/h1H2
InChIKey
LHMHCLYDBQOYTO-UHFFFAOYSA-N
Compound name
bromo(fluoro)methane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

8
References

5814
Patents

111.93239 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 112.93967 109.9
[M+Na]+ 134.92161 122.7
[M-H]- 110.92511 112.5
[M+NH4]+ 129.96621 136.1
[M+K]+ 150.89555 113.7
[M+H-H2O]+ 94.929650 111.1
[M+HCOO]- 156.93059 131.8
[M+CH3COO]- 170.94624 166.8
[M+Na-2H]- 132.90706 120.2
[M]+ 111.93184 126.6
[M]- 111.93294 126.6
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