CID 81357949

2-fluoro-2-(1-methylpiperidin-4-yl)acetic acid hydrochloride

Structural Information

Molecular Formula
C8H14FNO2
SMILES
CN1CCC(CC1)C(C(=O)O)F
InChI
InChI=1S/C8H14FNO2/c1-10-4-2-6(3-5-10)7(9)8(11)12/h6-7H,2-5H2,1H3,(H,11,12)
InChIKey
CMFIOLRJHZLOTG-UHFFFAOYSA-N
Compound name
2-fluoro-2-(1-methylpiperidin-4-yl)acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

175.10086 Da
Monoisotopic Mass

-1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 176.10814 137.7
[M+Na]+ 198.09008 142.7
[M-H]- 174.09358 136.5
[M+NH4]+ 193.13468 155.6
[M+K]+ 214.06402 141.7
[M+H-H2O]+ 158.09812 130.8
[M+HCOO]- 220.09906 153.0
[M+CH3COO]- 234.11471 178.1
[M+Na-2H]- 196.07553 139.2
[M]+ 175.10031 131.7
[M]- 175.10141 131.7
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.