CID 214253

1-(4-fluorophenyl)-2-(piperidin-1-yl)propan-1-one

Structural Information

Molecular Formula
C14H18FNO
SMILES
CC(C(=O)C1=CC=C(C=C1)F)N2CCCCC2
InChI
InChI=1S/C14H18FNO/c1-11(16-9-3-2-4-10-16)14(17)12-5-7-13(15)8-6-12/h5-8,11H,2-4,9-10H2,1H3
InChIKey
MRTWHZCMTBAXAE-UHFFFAOYSA-N
Compound name
1-(4-fluorophenyl)-2-piperidin-1-ylpropan-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

235.13724 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 236.144516 154.0
[M+Na]+ 258.126458 158.2
[M-H]- 234.129964 156.8
[M+NH4]+ 253.171063 169.7
[M+K]+ 274.100398 155.2
[M+H-H2O]+ 218.134500 145.0
[M+HCOO]- 280.135441 170.0
[M+CH3COO]- 294.151091 192.4
[M+Na-2H]- 256.111906 155.3
[M]+ 235.13669142 148.0
[M]- 235.13778858 148.0
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.