CID 1520158

690632-27-0

Structural Information

Molecular Formula

C₁₂H₂₂N₂O

SMILES

CC1CCN(CC1)C(=O)C2CCNCC2

InChI

InChI=1S/C12H22N2O/c1-10-4-8-14(9-5-10)12(15)11-2-6-13-7-3-11/h10-11,13H,2-9H2,1H3

InChIKey

MDXOMBYJWBMJGY-UHFFFAOYSA-N

Compound name

(4-methylpiperidin-1-yl)-piperidin-4-ylmethanone

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 6
Patents: 210.17322 Da
Monoisotopic Mass: 1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	211.18050	153.2
[M+Na]+	233.16244	162.6
[M+NH4]+	228.20704	160.9
[M+K]+	249.13638	156.7
[M-H]-	209.16594	155.1
[M+Na-2H]-	231.14789	157.2
[M]+	210.17267	154.7
[M]-	210.17377	154.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe