CID 16765164

358789-72-7

Structural Information

Molecular Formula

C₁₂H₁₈N₂O

SMILES

CN1CCC(CC1)OC2=CC=C(C=C2)N

InChI

InChI=1S/C12H18N2O/c1-14-8-6-12(7-9-14)15-11-4-2-10(13)3-5-11/h2-5,12H,6-9,13H2,1H3

InChIKey

CIVRCZPEYZHQDI-UHFFFAOYSA-N

Compound name

4-(1-methylpiperidin-4-yl)oxyaniline

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 142
Patents: 206.1419 Da
Monoisotopic Mass: 1.8
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]+	207.149176	147.3
[M+Na]+	229.131118	152.7
[M-H]-	205.134624	151.5
[M+NH4]+	224.175723	164.2
[M+K]+	245.105058	149.8
[M+H-H2O]+	189.139160	139.3
[M+HCOO]-	251.140101	167.3
[M+CH3COO]-	265.155751	188.1
[M+Na-2H]-	227.116566	151.4
[M]+	206.14135142	142.4
[M]-	206.14244858	142.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe