CID 12846025

1-bromo-2-(trifluoromethoxy)ethane

Structural Information

Molecular Formula
C3H4BrF3O
SMILES
C(CBr)OC(F)(F)F
InChI
InChI=1S/C3H4BrF3O/c4-1-2-8-3(5,6)7/h1-2H2
InChIKey
YLLDCQMJIXHFQZ-UHFFFAOYSA-N
Compound name
1-bromo-2-(trifluoromethoxy)ethane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

216
Patents

191.93976 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.94704 142.2
[M+Na]+ 214.92898 142.1
[M+NH4]+ 209.97358 144.9
[M+K]+ 230.90292 142.5
[M-H]- 190.93248 136.7
[M+Na-2H]- 212.91443 141.7
[M]+ 191.93921 139.3
[M]- 191.94031 139.3
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

patents stripe