CID 101028395

2-bromo-1,1-difluoro-1-methoxyethane

Structural Information

Molecular Formula
C3H5BrF2O
SMILES
COC(CBr)(F)F
InChI
InChI=1S/C3H5BrF2O/c1-7-3(5,6)2-4/h2H2,1H3
InChIKey
LVWDNJIGMDQHRM-UHFFFAOYSA-N
Compound name
2-bromo-1,1-difluoro-1-methoxyethane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

173.94917 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.956446 126.8
[M+Na]+ 196.938388 139.2
[M-H]- 172.941894 128.0
[M+NH4]+ 191.982993 150.7
[M+K]+ 212.912328 129.8
[M+H-H2O]+ 156.946430 126.9
[M+HCOO]- 218.947371 145.8
[M+CH3COO]- 232.963021 177.0
[M+Na-2H]- 194.923836 135.6
[M]+ 173.94862142 143.8
[M]- 173.94971858 143.8
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

No patent data available for this compound.