CID 165630649

1-(2,2-difluoroethyl)cyclopropan-1-ol

Structural Information

Molecular Formula
C5H8F2O
SMILES
C1CC1(CC(F)F)O
InChI
InChI=1S/C5H8F2O/c6-4(7)3-5(8)1-2-5/h4,8H,1-3H2
InChIKey
JUKHMYKDXTXUFM-UHFFFAOYSA-N
Compound name
1-(2,2-difluoroethyl)cyclopropan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

122.05432 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 123.06160 118.0
[M+Na]+ 145.04354 127.5
[M-H]- 121.04704 119.3
[M+NH4]+ 140.08814 136.6
[M+K]+ 161.01748 126.4
[M+H-H2O]+ 105.05158 112.3
[M+HCOO]- 167.05252 138.0
[M+CH3COO]- 181.06817 171.7
[M+Na-2H]- 143.02899 124.7
[M]+ 122.05377 117.2
[M]- 122.05487 117.2
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

No patent data available for this compound.