CID 165652312

2751614-28-3

Structural Information

Molecular Formula
C5H9F2N
SMILES
CC1(C(CN1)(F)F)C
InChI
InChI=1S/C5H9F2N/c1-4(2)5(6,7)3-8-4/h8H,3H2,1-2H3
InChIKey
RPVRKKXIZAWKRO-UHFFFAOYSA-N
Compound name
3,3-difluoro-2,2-dimethylazetidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

121.070305 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 122.077581 122.6
[M+Na]+ 144.059523 131.2
[M-H]- 120.063029 122.1
[M+NH4]+ 139.104128 140.9
[M+K]+ 160.033463 132.4
[M+H-H2O]+ 104.067565 113.7
[M+HCOO]- 166.068506 140.4
[M+CH3COO]- 180.084156 171.8
[M+Na-2H]- 142.044971 129.7
[M]+ 121.06975642 126.7
[M]- 121.07085358 126.7
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.