CID 1867002

86945-25-7

Structural Information

Molecular Formula

C₁₄H₂₂N₂

SMILES

C1CN(CCC1CCN)CC2=CC=CC=C2

InChI

InChI=1S/C14H22N2/c15-9-6-13-7-10-16(11-8-13)12-14-4-2-1-3-5-14/h1-5,13H,6-12,15H2

InChIKey

OUYRPOHWEJUTCQ-UHFFFAOYSA-N

Compound name

2-(1-benzylpiperidin-4-yl)ethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 354
Patents: 218.1783 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]+	219.18558	153.7
[M+Na]+	241.16752	165.5
[M+NH4]+	236.21212	162.8
[M+K]+	257.14146	157.4
[M-H]-	217.17102	158.6
[M+Na-2H]-	239.15297	161.3
[M]+	218.17775	156.7
[M]-	218.17885	156.7

Literature stripe

literature stripe

Patent stripe

patents stripe