CID 135031

N,n-diethyl-n'-methylurea

Structural Information

Molecular Formula

C₆H₁₄N₂O

SMILES

CCN(CC)C(=O)NC

InChI

InChI=1S/C6H14N2O/c1-4-8(5-2)6(9)7-3/h4-5H2,1-3H3,(H,7,9)

InChIKey

CSAUXMDYLYBUNJ-UHFFFAOYSA-N

Compound name

1,1-diethyl-3-methylurea

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 191
Patents: 130.11061 Da
Monoisotopic Mass: 0.3
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]+	131.11789	129.3
[M+Na]+	153.09983	137.8
[M+NH4]+	148.14443	137.0
[M+K]+	169.07377	133.3
[M-H]-	129.10333	129.8
[M+Na-2H]-	151.08528	133.1
[M]+	130.11006	130.3
[M]-	130.11116	130.3

Literature stripe

literature stripe

Patent stripe

patents stripe