CID 43650776

4-[5-(4-bromophenyl)-1h-imidazol-2-yl]piperidine

Structural Information

Molecular Formula
C14H16BrN3
SMILES
C1CNCCC1C2=NC=C(N2)C3=CC=C(C=C3)Br
InChI
InChI=1S/C14H16BrN3/c15-12-3-1-10(2-4-12)13-9-17-14(18-13)11-5-7-16-8-6-11/h1-4,9,11,16H,5-8H2,(H,17,18)
InChIKey
ZLTOWNBGCDROJM-UHFFFAOYSA-N
Compound name
4-[5-(4-bromophenyl)-1H-imidazol-2-yl]piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

305.05276 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 306.06004 164.5
[M+Na]+ 328.04198 173.3
[M-H]- 304.04548 169.7
[M+NH4]+ 323.08658 179.3
[M+K]+ 344.01592 159.7
[M+H-H2O]+ 288.05002 162.2
[M+HCOO]- 350.05096 178.0
[M+CH3COO]- 364.06661 175.7
[M+Na-2H]- 326.02743 167.8
[M]+ 305.05221 175.5
[M]- 305.05331 175.5
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.