CID 53256416

438056-67-8

Structural Information

Molecular Formula

C₁₁H₂₂N₂O

SMILES

C1CN(CCC1CN)C2CCOCC2

InChI

InChI=1S/C11H22N2O/c12-9-10-1-5-13(6-2-10)11-3-7-14-8-4-11/h10-11H,1-9,12H2

InChIKey

CNAWWTRDALPJDO-UHFFFAOYSA-N

Compound name

[1-(oxan-4-yl)piperidin-4-yl]methanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 8
Patents: 198.17322 Da
Monoisotopic Mass: 0.5
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]+	199.18050	148.9
[M+Na]+	221.16244	158.3
[M+NH4]+	216.20704	157.5
[M+K]+	237.13638	152.3
[M-H]-	197.16594	154.0
[M+Na-2H]-	219.14789	153.4
[M]+	198.17267	151.4
[M]-	198.17377	151.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe