CID 84647743

2377035-95-3

Structural Information

Molecular Formula
C6H12FN
SMILES
CC(C)(C1CNC1)F
InChI
InChI=1S/C6H12FN/c1-6(2,7)5-3-8-4-5/h5,8H,3-4H2,1-2H3
InChIKey
JJUKATXAIQVQNN-UHFFFAOYSA-N
Compound name
3-(2-fluoropropan-2-yl)azetidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

117.095375 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 118.10265 126.4
[M+Na]+ 140.08459 131.6
[M+NH4]+ 135.12920 130.3
[M+K]+ 156.05853 128.7
[M-H]- 116.08810 122.5
[M+Na-2H]- 138.07004 128.3
[M]+ 117.09483 124.7
[M]- 117.09592 124.7
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.