CID 4252767

2-(3-methoxyphenyl)piperazine

Structural Information

Molecular Formula

C₁₁H₁₆N₂O

SMILES

COC1=CC=CC(=C1)C2CNCCN2

InChI

InChI=1S/C11H16N2O/c1-14-10-4-2-3-9(7-10)11-8-12-5-6-13-11/h2-4,7,11-13H,5-6,8H2,1H3

InChIKey

SAQIBFOALNPYFY-UHFFFAOYSA-N

Compound name

2-(3-methoxyphenyl)piperazine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 42
Patents: 192.12627 Da
Monoisotopic Mass: 0.6
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]+	193.13355	144.8
[M+Na]+	215.11549	157.0
[M+NH4]+	210.16009	152.9
[M+K]+	231.08943	150.3
[M-H]-	191.11899	147.3
[M+Na-2H]-	213.10094	151.8
[M]+	192.12572	147.1
[M]-	192.12682	147.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe