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]+ 122.07758 122.6
[M+Na]+ 144.05952 131.2
[M-H]- 120.06303 122.1
[M+NH4]+ 139.10413 140.9
[M+K]+ 160.03346 132.4
[M+H-H2O]+ 104.06756 113.7
[M+HCOO]- 166.06851 140.4
[M+CH3COO]- 180.08416 171.8
[M+Na-2H]- 142.04497 129.7
[M]+ 121.06976 126.7
[M]- 121.07085 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.