CID 165750309

2803856-66-6

Structural Information

Molecular Formula
C10H17F2NO2
SMILES
CCOC(=O)C(CC1CCNCC1)(F)F
InChI
InChI=1S/C10H17F2NO2/c1-2-15-9(14)10(11,12)7-8-3-5-13-6-4-8/h8,13H,2-7H2,1H3
InChIKey
NRMVAPZYZJDXAD-UHFFFAOYSA-N
Compound name
ethyl 2,2-difluoro-3-piperidin-4-ylpropanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

221.12274 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 222.13002 149.9
[M+Na]+ 244.11196 153.9
[M-H]- 220.11546 146.8
[M+NH4]+ 239.15656 165.8
[M+K]+ 260.08590 151.9
[M+H-H2O]+ 204.12000 141.9
[M+HCOO]- 266.12094 162.9
[M+CH3COO]- 280.13659 184.5
[M+Na-2H]- 242.09741 152.4
[M]+ 221.12219 143.1
[M]- 221.12329 143.1
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.