CID 78061721

3,3-difluoro-2-methylpropan-1-ol

Structural Information

Molecular Formula
C4H8F2O
SMILES
CC(CO)C(F)F
InChI
InChI=1S/C4H8F2O/c1-3(2-7)4(5)6/h3-4,7H,2H2,1H3
InChIKey
LVDIZMUAQNVFOZ-UHFFFAOYSA-N
Compound name
3,3-difluoro-2-methylpropan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

110.05432 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 111.06160 122.3
[M+Na]+ 133.04354 130.4
[M+NH4]+ 128.08814 128.9
[M+K]+ 149.01748 126.4
[M-H]- 109.04704 118.4
[M+Na-2H]- 131.02899 124.5
[M]+ 110.05377 121.9
[M]- 110.05487 121.9
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