CID 154204660

3-bromo-3,3-difluoropropan-1-ol

Structural Information

Molecular Formula
C3H5BrF2O
SMILES
C(CO)C(F)(F)Br
InChI
InChI=1S/C3H5BrF2O/c4-3(5,6)1-2-7/h7H,1-2H2
InChIKey
VOVIJZMMPQFCRY-UHFFFAOYSA-N
Compound name
3-bromo-3,3-difluoropropan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

173.94917 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.95645 134.4
[M+Na]+ 196.93839 134.6
[M+NH4]+ 191.98299 137.7
[M+K]+ 212.91233 135.6
[M-H]- 172.94189 129.7
[M+Na-2H]- 194.92384 134.3
[M]+ 173.94862 131.7
[M]- 173.94972 131.7
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