CID 16640768

3-ethyl-1-(4-hydroxycyclohexyl)urea

Structural Information

Molecular Formula

C₉H₁₈N₂O₂

SMILES

CCNC(=O)NC1CCC(CC1)O

InChI

InChI=1S/C9H18N2O2/c1-2-10-9(13)11-7-3-5-8(12)6-4-7/h7-8,12H,2-6H2,1H3,(H2,10,11,13)

InChIKey

BDIMVNHBVCPOFN-UHFFFAOYSA-N

Compound name

1-ethyl-3-(4-hydroxycyclohexyl)urea

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 186.13683 Da
Monoisotopic Mass: 0.4
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]+	187.14411	143.0
[M+Na]+	209.12605	150.2
[M+NH4]+	204.17065	150.0
[M+K]+	225.09999	145.7
[M-H]-	185.12955	144.3
[M+Na-2H]-	207.11150	146.1
[M]+	186.13628	143.8
[M]-	186.13738	143.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe