CID 145874409

2375271-52-4

Structural Information

Molecular Formula
C10H15F3N2O2
SMILES
C1CN(CCC1C2(CNC2)O)C(=O)C(F)(F)F
InChI
InChI=1S/C10H15F3N2O2/c11-10(12,13)8(16)15-3-1-7(2-4-15)9(17)5-14-6-9/h7,14,17H,1-6H2
InChIKey
FGJOFIUFXZSYHL-UHFFFAOYSA-N
Compound name
2,2,2-trifluoro-1-[4-(3-hydroxyazetidin-3-yl)piperidin-1-yl]ethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

252.10857 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 253.11585 158.6
[M+Na]+ 275.09779 162.4
[M-H]- 251.10129 155.1
[M+NH4]+ 270.14239 166.7
[M+K]+ 291.07173 162.3
[M+H-H2O]+ 235.10583 144.9
[M+HCOO]- 297.10677 166.1
[M+CH3COO]- 311.12242 189.1
[M+Na-2H]- 273.08324 159.7
[M]+ 252.10802 155.9
[M]- 252.10912 155.9
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

No patent data available for this compound.