CID 215909

1-(4-(4-fluorophenyl)-4-oxobutyl)-4-benzamidopiperidine hydrochloride

Structural Information

Molecular Formula
C22H25FN2O2
SMILES
C1CN(CCC1NC(=O)C2=CC=CC=C2)CCCC(=O)C3=CC=C(C=C3)F
InChI
InChI=1S/C22H25FN2O2/c23-19-10-8-17(9-11-19)21(26)7-4-14-25-15-12-20(13-16-25)24-22(27)18-5-2-1-3-6-18/h1-3,5-6,8-11,20H,4,7,12-16H2,(H,24,27)
InChIKey
NOMPHPRJDQKAFF-UHFFFAOYSA-N
Compound name
N-[1-[4-(4-fluorophenyl)-4-oxobutyl]piperidin-4-yl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

5
Patents

368.19 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 369.19728 191.6
[M+Na]+ 391.17922 202.5
[M+NH4]+ 386.22382 197.7
[M+K]+ 407.15316 194.7
[M-H]- 367.18272 195.6
[M+Na-2H]- 389.16467 198.6
[M]+ 368.18945 193.9
[M]- 368.19055 193.9
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