CID 3351962

1030610-75-3

Structural Information

Molecular Formula
C13H16FNO2
SMILES
C1CCN(C(C1)C(=O)O)CC2=CC=C(C=C2)F
InChI
InChI=1S/C13H16FNO2/c14-11-6-4-10(5-7-11)9-15-8-2-1-3-12(15)13(16)17/h4-7,12H,1-3,8-9H2,(H,16,17)
InChIKey
WRCCKEVVICUODU-UHFFFAOYSA-N
Compound name
1-[(4-fluorophenyl)methyl]piperidine-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

237.1165 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 238.12378 155.3
[M+Na]+ 260.10572 166.3
[M+NH4]+ 255.15032 162.3
[M+K]+ 276.07966 160.1
[M-H]- 236.10922 156.5
[M+Na-2H]- 258.09117 160.7
[M]+ 237.11595 156.9
[M]- 237.11705 156.9
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.