CID 53279

Morlincain

Structural Information

Molecular Formula

C₁₄H₂₀N₂O₂

SMILES

CC1=C(C(=CC=C1)C)NC(=O)CN2CCOCC2

InChI

InChI=1S/C14H20N2O2/c1-11-4-3-5-12(2)14(11)15-13(17)10-16-6-8-18-9-7-16/h3-5H,6-10H2,1-2H3,(H,15,17)

InChIKey

SOFDCJAETSXSQK-UHFFFAOYSA-N

Compound name

N-(2,6-dimethylphenyl)-2-morpholin-4-ylacetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 4
References: 8
Patents: 248.15248 Da
Monoisotopic Mass: 1.5
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]+	249.15976	159.4
[M+Na]+	271.14170	164.0
[M-H]-	247.14520	164.6
[M+NH4]+	266.18630	173.4
[M+K]+	287.11564	162.4
[M+H-H2O]+	231.14974	150.9
[M+HCOO]-	293.15068	177.8
[M+CH3COO]-	307.16633	196.4
[M+Na-2H]-	269.12715	162.9
[M]+	248.15193	156.8
[M]-	248.15303	156.8

Literature stripe

literature stripe

Patent stripe

patents stripe