CID 681892

N-(4-methoxyphenyl)-2-(4-methylphenoxy)acetamide

Structural Information

Molecular Formula

C₁₆H₁₇NO₃

SMILES

CC1=CC=C(C=C1)OCC(=O)NC2=CC=C(C=C2)OC

InChI

InChI=1S/C16H17NO3/c1-12-3-7-15(8-4-12)20-11-16(18)17-13-5-9-14(19-2)10-6-13/h3-10H,11H2,1-2H3,(H,17,18)

InChIKey

FRZYSRGIJHSQIU-UHFFFAOYSA-N

Compound name

N-(4-methoxyphenyl)-2-(4-methylphenoxy)acetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 1
Patents: 271.12085 Da
Monoisotopic Mass: 3.1
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]+	272.128126	161.8
[M+Na]+	294.110068	168.4
[M-H]-	270.113574	168.6
[M+NH4]+	289.154673	177.7
[M+K]+	310.084008	165.7
[M+H-H2O]+	254.118110	153.7
[M+HCOO]-	316.119051	186.4
[M+CH3COO]-	330.134701	200.7
[M+Na-2H]-	292.095516	166.5
[M]+	271.12030142	164.5
[M]-	271.12139858	164.5

Literature stripe

literature stripe

Patent stripe

patents stripe