CID 9625

Bromochlorodifluoromethane

Structural Information

Molecular Formula
CBrClF2
SMILES
C(F)(F)(Cl)Br
InChI
InChI=1S/CBrClF2/c2-1(3,4)5
InChIKey
MEXUFEQDCXZEON-UHFFFAOYSA-N
Compound name
bromo-chloro-difluoromethane
Related CIDs

2D Structure

compound 2d structure
7
Annotation Hits

20
References

3195
Patents

163.884 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 164.89128 118.5
[M+Na]+ 186.87322 132.7
[M-H]- 162.87672 120.0
[M+NH4]+ 181.91782 143.6
[M+K]+ 202.84716 121.2
[M+H-H2O]+ 146.88126 120.0
[M+HCOO]- 208.88220 133.6
[M+CH3COO]- 222.89785 173.3
[M+Na-2H]- 184.85867 128.2
[M]+ 163.88345 135.1
[M]- 163.88455 135.1
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