CID 2760337

5-phenoxy-o-anisidine

Structural Information

Molecular Formula

C₁₃H₁₃NO₂

SMILES

COC1=C(C=C(C=C1)OC2=CC=CC=C2)N

InChI

InChI=1S/C13H13NO2/c1-15-13-8-7-11(9-12(13)14)16-10-5-3-2-4-6-10/h2-9H,14H2,1H3

InChIKey

SCDKUQBOSDILAR-UHFFFAOYSA-N

Compound name

2-methoxy-5-phenoxyaniline

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 108
Patents: 215.09464 Da
Monoisotopic Mass: 2.8
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]+	216.10192	146.8
[M+Na]+	238.08386	161.3
[M+NH4]+	233.12846	155.9
[M+K]+	254.05780	153.8
[M-H]-	214.08736	152.2
[M+Na-2H]-	236.06931	156.8
[M]+	215.09409	150.5
[M]-	215.09519	150.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe