CID 214210

27922-08-3

Structural Information

Molecular Formula
C15H20FNO
SMILES
CC1CCCN(C1)CCC(=O)C2=CC=C(C=C2)F
InChI
InChI=1S/C15H20FNO/c1-12-3-2-9-17(11-12)10-8-15(18)13-4-6-14(16)7-5-13/h4-7,12H,2-3,8-11H2,1H3
InChIKey
MZXJVYLHWCUWIA-UHFFFAOYSA-N
Compound name
1-(4-fluorophenyl)-3-(3-methylpiperidin-1-yl)propan-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

249.1529 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 250.160176 158.4
[M+Na]+ 272.142118 163.4
[M-H]- 248.145624 161.3
[M+NH4]+ 267.186723 173.9
[M+K]+ 288.116058 159.7
[M+H-H2O]+ 232.150160 149.3
[M+HCOO]- 294.151101 175.1
[M+CH3COO]- 308.166751 195.7
[M+Na-2H]- 270.127566 159.7
[M]+ 249.15235142 153.8
[M]- 249.15344858 153.8
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.