CID 55278622

1-(2-fluoroethyl)piperidine-4-carboxylic acid hydrochloride

Structural Information

Molecular Formula
C8H14FNO2
SMILES
C1CN(CCC1C(=O)O)CCF
InChI
InChI=1S/C8H14FNO2/c9-3-6-10-4-1-7(2-5-10)8(11)12/h7H,1-6H2,(H,11,12)
InChIKey
LWXZHFKIVVWVEK-UHFFFAOYSA-N
Compound name
1-(2-fluoroethyl)piperidine-4-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

175.10086 Da
Monoisotopic Mass

-1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 176.108136 137.7
[M+Na]+ 198.090078 142.9
[M-H]- 174.093584 136.4
[M+NH4]+ 193.134683 155.6
[M+K]+ 214.064018 141.4
[M+H-H2O]+ 158.098120 130.6
[M+HCOO]- 220.099061 154.0
[M+CH3COO]- 234.114711 177.2
[M+Na-2H]- 196.075526 140.4
[M]+ 175.10031142 132.3
[M]- 175.10140858 132.3
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

patents stripe