CID 199195

(1-ethylcyclopentyl)urea

Structural Information

Molecular Formula

C₈H₁₆N₂O

SMILES

CCC1(CCCC1)NC(=O)N

InChI

InChI=1S/C8H16N2O/c1-2-8(10-7(9)11)5-3-4-6-8/h2-6H2,1H3,(H3,9,10,11)

InChIKey

ZVELGQJLEWIYHZ-UHFFFAOYSA-N

Compound name

(1-ethylcyclopentyl)urea

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 156.12627 Da
Monoisotopic Mass: 0.9
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]+	157.13355	136.1
[M+Na]+	179.11549	142.8
[M+NH4]+	174.16009	145.3
[M+K]+	195.08943	138.2
[M-H]-	155.11899	137.5
[M+Na-2H]-	177.10094	140.9
[M]+	156.12572	137.1
[M]-	156.12682	137.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe