CID 3063704

101500-15-6

Structural Information

Molecular Formula
C15H21BrN2O
SMILES
CC(CC(=O)NC1=CC=C(C=C1)Br)N2CCCCC2
InChI
InChI=1S/C15H21BrN2O/c1-12(18-9-3-2-4-10-18)11-15(19)17-14-7-5-13(16)6-8-14/h5-8,12H,2-4,9-11H2,1H3,(H,17,19)
InChIKey
FSCXGPLUUCKGPH-UHFFFAOYSA-N
Compound name
N-(4-bromophenyl)-3-piperidin-1-ylbutanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

324.08374 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 325.09102 167.3
[M+Na]+ 347.07296 168.6
[M+NH4]+ 342.11756 171.4
[M+K]+ 363.04690 168.3
[M-H]- 323.07646 169.2
[M+Na-2H]- 345.05841 170.3
[M]+ 324.08319 166.6
[M]- 324.08429 166.6
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.