CID 20222835

102196-20-3

Structural Information

Molecular Formula

C₁₀H₁₅NO₂

SMILES

COCCOC1=CC=C(C=C1)CN

InChI

InChI=1S/C10H15NO2/c1-12-6-7-13-10-4-2-9(8-11)3-5-10/h2-5H,6-8,11H2,1H3

InChIKey

PARWGYPSBMSXSC-UHFFFAOYSA-N

Compound name

[4-(2-methoxyethoxy)phenyl]methanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 21
Patents: 181.11028 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]+	182.11756	139.0
[M+Na]+	204.09950	150.7
[M+NH4]+	199.14410	147.3
[M+K]+	220.07344	144.2
[M-H]-	180.10300	141.5
[M+Na-2H]-	202.08495	145.7
[M]+	181.10973	141.3
[M]-	181.11083	141.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe