CID 117257

1-acetyl-4-(4-fluorobenzoyl)piperidine

Structural Information

Molecular Formula
C14H16FNO2
SMILES
CC(=O)N1CCC(CC1)C(=O)C2=CC=C(C=C2)F
InChI
InChI=1S/C14H16FNO2/c1-10(17)16-8-6-12(7-9-16)14(18)11-2-4-13(15)5-3-11/h2-5,12H,6-9H2,1H3
InChIKey
JCGSSOIJYPBNJE-UHFFFAOYSA-N
Compound name
1-[4-(4-fluorobenzoyl)piperidin-1-yl]ethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

103
Patents

249.1165 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 250.12378 155.6
[M+Na]+ 272.10572 161.1
[M-H]- 248.10922 158.9
[M+NH4]+ 267.15032 171.0
[M+K]+ 288.07966 158.1
[M+H-H2O]+ 232.11376 146.8
[M+HCOO]- 294.11470 172.1
[M+CH3COO]- 308.13035 194.1
[M+Na-2H]- 270.09117 156.3
[M]+ 249.11595 150.7
[M]- 249.11705 150.7
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

patents stripe