CID 4169913

N-cyclohexyl-n'-(2-methoxy-1-methylethyl)urea

Structural Information

Molecular Formula
C11H22N2O2
SMILES
CC(COC)NC(=O)NC1CCCCC1
InChI
InChI=1S/C11H22N2O2/c1-9(8-15-2)12-11(14)13-10-6-4-3-5-7-10/h9-10H,3-8H2,1-2H3,(H2,12,13,14)
InChIKey
RIXRDZWCLBREIA-UHFFFAOYSA-N
Compound name
1-cyclohexyl-3-(1-methoxypropan-2-yl)urea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

214.16812 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.175396 152.1
[M+Na]+ 237.157338 153.6
[M-H]- 213.160844 154.1
[M+NH4]+ 232.201943 169.6
[M+K]+ 253.131278 153.3
[M+H-H2O]+ 197.165380 145.2
[M+HCOO]- 259.166321 172.3
[M+CH3COO]- 273.181971 191.9
[M+Na-2H]- 235.142786 154.3
[M]+ 214.16757142 147.6
[M]- 214.16866858 147.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.