CID 89401815

1-(3-fluoroazetidin-3-yl)-n,n-dimethylmethanamine dihydrochloride

Structural Information

Molecular Formula
C6H13FN2
SMILES
CN(C)CC1(CNC1)F
InChI
InChI=1S/C6H13FN2/c1-9(2)5-6(7)3-8-4-6/h8H,3-5H2,1-2H3
InChIKey
SCFXHXRIAONXON-UHFFFAOYSA-N
Compound name
1-(3-fluoroazetidin-3-yl)-N,N-dimethylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

20
Patents

132.10628 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 133.11356 130.0
[M+Na]+ 155.09550 135.3
[M-H]- 131.09900 130.9
[M+NH4]+ 150.14010 145.7
[M+K]+ 171.06944 138.1
[M+H-H2O]+ 115.10354 119.0
[M+HCOO]- 177.10448 149.7
[M+CH3COO]- 191.12013 179.2
[M+Na-2H]- 153.08095 136.0
[M]+ 132.10573 135.2
[M]- 132.10683 135.2
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

No patent data available for this compound.