CID 199493

1-(2-(diphenylamino)ethyl)-1-methylpiperidinium bromide

Structural Information

Molecular Formula
C20H27N2
SMILES
C[N+]1(CCCCC1)CCN(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C20H27N2/c1-22(16-9-4-10-17-22)18-15-21(19-11-5-2-6-12-19)20-13-7-3-8-14-20/h2-3,5-8,11-14H,4,9-10,15-18H2,1H3/q+1
InChIKey
NLZPIOVHCSIGLO-UHFFFAOYSA-N
Compound name
N-[2-(1-methylpiperidin-1-ium-1-yl)ethyl]-N-phenylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

295.21744 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 296.22472 173.1
[M+Na]+ 318.20666 189.1
[M+NH4]+ 313.25126 185.5
[M+K]+ 334.18060 177.8
[M-H]- 294.21016 182.9
[M+Na-2H]- 316.19211 186.8
[M]+ 295.21689 178.9
[M]- 295.21799 178.9
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.