CID 14641

1219-36-9

Structural Information

Molecular Formula
C15H20FNO
SMILES
C1CCN(CC1)CCCC(=O)C2=CC=C(C=C2)F
InChI
InChI=1S/C15H20FNO/c16-14-8-6-13(7-9-14)15(18)5-4-12-17-10-2-1-3-11-17/h6-9H,1-5,10-12H2
InChIKey
LUKOGYUKYPZBFP-UHFFFAOYSA-N
Compound name
1-(4-fluorophenyl)-4-piperidin-1-ylbutan-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

584
Patents

249.1529 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 250.16018 158.7
[M+Na]+ 272.14212 162.7
[M-H]- 248.14562 161.2
[M+NH4]+ 267.18672 173.9
[M+K]+ 288.11606 158.9
[M+H-H2O]+ 232.15016 149.3
[M+HCOO]- 294.15110 175.4
[M+CH3COO]- 308.16675 194.5
[M+Na-2H]- 270.12757 160.6
[M]+ 249.15235 153.6
[M]- 249.15345 153.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe