CID 12758276

3-(1-phenylethoxy)pyridin-2-amine

Structural Information

Molecular Formula

C₁₃H₁₄N₂O

SMILES

CC(C1=CC=CC=C1)OC2=C(N=CC=C2)N

InChI

InChI=1S/C13H14N2O/c1-10(11-6-3-2-4-7-11)16-12-8-5-9-15-13(12)14/h2-10H,1H3,(H2,14,15)

InChIKey

PPDXZQYCEONNNJ-UHFFFAOYSA-N

Compound name

3-(1-phenylethoxy)pyridin-2-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 17
Patents: 214.11061 Da
Monoisotopic Mass: 2.4
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]+	215.11789	148.1
[M+Na]+	237.09983	162.1
[M+NH4]+	232.14443	156.8
[M+K]+	253.07377	154.9
[M-H]-	213.10333	152.8
[M+Na-2H]-	235.08528	157.9
[M]+	214.11006	151.4
[M]-	214.11116	151.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe