CID 2761401

(2,2-difluorocyclopropyl)methanol

Structural Information

Molecular Formula
C4H6F2O
SMILES
C1C(C1(F)F)CO
InChI
InChI=1S/C4H6F2O/c5-4(6)1-3(4)2-7/h3,7H,1-2H2
InChIKey
XOLSMTBBIZDHSG-UHFFFAOYSA-N
Compound name
(2,2-difluorocyclopropyl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

523
Patents

108.03867 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 109.04595 113.1
[M+Na]+ 131.02789 124.2
[M-H]- 107.03139 114.8
[M+NH4]+ 126.07249 132.6
[M+K]+ 147.00183 122.8
[M+H-H2O]+ 91.035930 107.7
[M+HCOO]- 153.03687 134.3
[M+CH3COO]- 167.05252 169.0
[M+Na-2H]- 129.01334 120.9
[M]+ 108.03812 112.9
[M]- 108.03922 112.9
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