CID 72698925

(1-fluorocyclobutyl)methanol

Structural Information

Molecular Formula
C5H9FO
SMILES
C1CC(C1)(CO)F
InChI
InChI=1S/C5H9FO/c6-5(4-7)2-1-3-5/h7H,1-4H2
InChIKey
KKIPAQKFWDBCFV-UHFFFAOYSA-N
Compound name
(1-fluorocyclobutyl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

104.06374 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 105.07102 120.7
[M+Na]+ 127.05296 126.3
[M+NH4]+ 122.09756 126.5
[M+K]+ 143.02690 121.1
[M-H]- 103.05646 117.7
[M+Na-2H]- 125.03841 124.4
[M]+ 104.06319 119.4
[M]- 104.06429 119.4
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