CID 102168702

2-(1,1,2,2,2-pentafluoroethyl)piperidine hydrochloride

Structural Information

Molecular Formula
C7H10F5N
SMILES
C1CCNC(C1)C(C(F)(F)F)(F)F
InChI
InChI=1S/C7H10F5N/c8-6(9,7(10,11)12)5-3-1-2-4-13-5/h5,13H,1-4H2
InChIKey
KXCRHQQTUZNGQO-UHFFFAOYSA-N
Compound name
2-(1,1,2,2,2-pentafluoroethyl)piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

203.07333 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 204.08061 139.6
[M+Na]+ 226.06255 145.5
[M-H]- 202.06605 133.2
[M+NH4]+ 221.10715 156.2
[M+K]+ 242.03649 142.5
[M+H-H2O]+ 186.07059 130.0
[M+HCOO]- 248.07153 149.1
[M+CH3COO]- 262.08718 180.7
[M+Na-2H]- 224.04800 143.6
[M]+ 203.07278 125.8
[M]- 203.07388 125.8
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.