CID 2627719

2-(2-methoxy-4-methylphenoxy)-n-phenylacetamide

Structural Information

Molecular Formula

C₁₆H₁₇NO₃

SMILES

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

InChI

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

InChIKey

NEMOSCRCJWXSPN-UHFFFAOYSA-N

Compound name

2-(2-methoxy-4-methylphenoxy)-N-phenylacetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
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

No literature data available for this compound.

Patent stripe

No patent data available for this compound.