CID 84762105

[1-(fluoromethyl)cyclobutyl]methanol

Structural Information

Molecular Formula
C6H11FO
SMILES
C1CC(C1)(CO)CF
InChI
InChI=1S/C6H11FO/c7-4-6(5-8)2-1-3-6/h8H,1-5H2
InChIKey
XPSSLCKRFDOFFL-UHFFFAOYSA-N
Compound name
[1-(fluoromethyl)cyclobutyl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

118.07939 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 119.08667 122.2
[M+Na]+ 141.06861 128.4
[M-H]- 117.07211 123.4
[M+NH4]+ 136.11321 139.5
[M+K]+ 157.04255 130.2
[M+H-H2O]+ 101.07665 113.3
[M+HCOO]- 163.07759 142.1
[M+CH3COO]- 177.09324 170.6
[M+Na-2H]- 139.05406 129.1
[M]+ 118.07884 128.0
[M]- 118.07994 128.0
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