CID 1096081

871112-85-5

Structural Information

Molecular Formula

C₁₃H₂₀N₂

SMILES

CN(CC1=CC=CC=C1)C2CCNCC2

InChI

InChI=1S/C13H20N2/c1-15(13-7-9-14-10-8-13)11-12-5-3-2-4-6-12/h2-6,13-14H,7-11H2,1H3

InChIKey

JQSWRIGANADNJD-UHFFFAOYSA-N

Compound name

N-benzyl-N-methylpiperidin-4-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 3
References: 112
Patents: 204.16264 Da
Monoisotopic Mass: 1.9
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]+	205.16992	149.5
[M+Na]+	227.15186	161.1
[M+NH4]+	222.19646	158.7
[M+K]+	243.12580	153.5
[M-H]-	203.15536	154.3
[M+Na-2H]-	225.13731	157.7
[M]+	204.16209	152.4
[M]-	204.16319	152.4

Literature stripe

literature stripe

Patent stripe

patents stripe