CID 90428176

1-(3-methoxypropyl)imidazolidin-2-one

Structural Information

Molecular Formula

C₇H₁₄N₂O₂

SMILES

COCCCN1CCNC1=O

InChI

InChI=1S/C7H14N2O2/c1-11-6-2-4-9-5-3-8-7(9)10/h2-6H2,1H3,(H,8,10)

InChIKey

OJUGTWMWSSKCBJ-UHFFFAOYSA-N

Compound name

1-(3-methoxypropyl)imidazolidin-2-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 4
Patents: 158.10553 Da
Monoisotopic Mass: -0.5
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]+	159.112806	135.0
[M+Na]+	181.094748	141.7
[M-H]-	157.098254	133.9
[M+NH4]+	176.139353	154.2
[M+K]+	197.068688	140.4
[M+H-H2O]+	141.102790	128.1
[M+HCOO]-	203.103731	154.4
[M+CH3COO]-	217.119381	173.1
[M+Na-2H]-	179.080196	138.5
[M]+	158.10498142	133.6
[M]-	158.10607858	133.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe