CID 53346590

(3-fluorooxetan-3-yl)methanamine

Structural Information

Molecular Formula
C4H8FNO
SMILES
C1C(CO1)(CN)F
InChI
InChI=1S/C4H8FNO/c5-4(1-6)2-7-3-4/h1-3,6H2
InChIKey
CKOHQNWYAGJORO-UHFFFAOYSA-N
Compound name
(3-fluorooxetan-3-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

167
Patents

105.05899 Da
Monoisotopic Mass

-0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 106.06627 116.2
[M+Na]+ 128.04821 122.5
[M-H]- 104.05171 119.0
[M+NH4]+ 123.09281 132.8
[M+K]+ 144.02215 126.4
[M+H-H2O]+ 88.056250 106.6
[M+HCOO]- 150.05719 137.6
[M+CH3COO]- 164.07284 171.0
[M+Na-2H]- 126.03366 124.8
[M]+ 105.05844 121.9
[M]- 105.05954 121.9
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