CID 132362780

Ethyl 4-(2,2-difluoroethyl)piperidine-4-carboxylate hydrochloride

Structural Information

Molecular Formula
C10H17F2NO2
SMILES
CCOC(=O)C1(CCNCC1)CC(F)F
InChI
InChI=1S/C10H17F2NO2/c1-2-15-9(14)10(7-8(11)12)3-5-13-6-4-10/h8,13H,2-7H2,1H3
InChIKey
DWEITKQMVGLAOW-UHFFFAOYSA-N
Compound name
ethyl 4-(2,2-difluoroethyl)piperidine-4-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

221.12274 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 222.13002 149.9
[M+Na]+ 244.11196 154.2
[M-H]- 220.11546 146.9
[M+NH4]+ 239.15656 167.7
[M+K]+ 260.08590 152.5
[M+H-H2O]+ 204.12000 142.3
[M+HCOO]- 266.12094 163.5
[M+CH3COO]- 280.13659 184.6
[M+Na-2H]- 242.09741 151.6
[M]+ 221.12219 143.3
[M]- 221.12329 143.3
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.