CID 6402

1,2-dibromo-1,1-difluoroethane

Structural Information

Molecular Formula
C2H2Br2F2
SMILES
C(C(F)(F)Br)Br
InChI
InChI=1S/C2H2Br2F2/c3-1-2(4,5)6/h1H2
InChIKey
DPOZWTRVXPUOQW-UHFFFAOYSA-N
Compound name
1,2-dibromo-1,1-difluoroethane
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

1
References

337
Patents

221.84914 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 222.85642 128.6
[M+Na]+ 244.83836 140.7
[M-H]- 220.84186 131.3
[M+NH4]+ 239.88296 150.2
[M+K]+ 260.81230 125.5
[M+H-H2O]+ 204.84640 136.4
[M+HCOO]- 266.84734 142.8
[M+CH3COO]- 280.86299 192.3
[M+Na-2H]- 242.82381 137.1
[M]+ 221.84859 159.6
[M]- 221.84969 159.6
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