CID 137374560

[1-(2,2-difluoroethyl)cyclopropyl]methanol

Structural Information

Molecular Formula
C6H10F2O
SMILES
C1CC1(CC(F)F)CO
InChI
InChI=1S/C6H10F2O/c7-5(8)3-6(4-9)1-2-6/h5,9H,1-4H2
InChIKey
OYVKBVGEXWKUHE-UHFFFAOYSA-N
Compound name
[1-(2,2-difluoroethyl)cyclopropyl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

136.06998 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 137.077256 122.3
[M+Na]+ 159.059198 131.4
[M-H]- 135.062704 123.4
[M+NH4]+ 154.103803 140.4
[M+K]+ 175.033138 130.0
[M+H-H2O]+ 119.067240 116.3
[M+HCOO]- 181.068181 141.9
[M+CH3COO]- 195.083831 174.5
[M+Na-2H]- 157.044646 128.5
[M]+ 136.06943142 121.8
[M]- 136.07052858 121.8
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