CID 19471

N,n-ethylene-n'-isopropylurea

Structural Information

Molecular Formula

C₆H₁₂N₂O

SMILES

CC(C)NC(=O)N1CC1

InChI

InChI=1S/C6H12N2O/c1-5(2)7-6(9)8-3-4-8/h5H,3-4H2,1-2H3,(H,7,9)

InChIKey

ZSBNMEOIEVHFJT-UHFFFAOYSA-N

Compound name

N-propan-2-ylaziridine-1-carboxamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 128.09496 Da
Monoisotopic Mass: 0.1
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]+	129.10224	127.9
[M+Na]+	151.08418	138.5
[M+NH4]+	146.12878	136.0
[M+K]+	167.05812	135.9
[M-H]-	127.08768	135.0
[M+Na-2H]-	149.06963	134.8
[M]+	128.09441	132.2
[M]-	128.09551	132.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe