CID 110459912

1602185-16-9

Structural Information

Molecular Formula
C9H18N2O2
SMILES
CN(C)C(=O)NC1CCC(CC1)O
InChI
InChI=1S/C9H18N2O2/c1-11(2)9(13)10-7-3-5-8(12)6-4-7/h7-8,12H,3-6H2,1-2H3,(H,10,13)
InChIKey
UGIISPDSWGWEDS-UHFFFAOYSA-N
Compound name
3-(4-hydroxycyclohexyl)-1,1-dimethylurea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

186.13683 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 187.144106 142.9
[M+Na]+ 209.126048 146.2
[M-H]- 185.129554 145.7
[M+NH4]+ 204.170653 161.9
[M+K]+ 225.099988 146.4
[M+H-H2O]+ 169.134090 136.7
[M+HCOO]- 231.135031 163.7
[M+CH3COO]- 245.150681 187.0
[M+Na-2H]- 207.111496 145.4
[M]+ 186.13628142 138.1
[M]- 186.13737858 138.1
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.