CID 186068

N-(2-methoxyethyl)urea

Structural Information

Molecular Formula

C₄H₁₀N₂O₂

SMILES

COCCNC(=O)N

InChI

InChI=1S/C4H10N2O2/c1-8-3-2-6-4(5)7/h2-3H2,1H3,(H3,5,6,7)

InChIKey

IHCDQQHNHQCALV-UHFFFAOYSA-N

Compound name

2-methoxyethylurea

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 240
Patents: 118.07423 Da
Monoisotopic Mass: -1.2
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]+	119.08151	123.0
[M+Na]+	141.06345	129.4
[M-H]-	117.06695	123.1
[M+NH4]+	136.10805	144.6
[M+K]+	157.03739	130.0
[M+H-H2O]+	101.07149	117.8
[M+HCOO]-	163.07243	148.5
[M+CH3COO]-	177.08808	173.4
[M+Na-2H]-	139.04890	129.2
[M]+	118.07368	122.3
[M]-	118.07478	122.3

Literature stripe

literature stripe

Patent stripe

patents stripe