CID 308068

N,n-dicyclohexyl-n'-methylurea

Structural Information

Molecular Formula

C₁₄H₂₆N₂O

SMILES

CNC(=O)N(C1CCCCC1)C2CCCCC2

InChI

InChI=1S/C14H26N2O/c1-15-14(17)16(12-8-4-2-5-9-12)13-10-6-3-7-11-13/h12-13H,2-11H2,1H3,(H,15,17)

InChIKey

HPROJXIYPFCVAJ-UHFFFAOYSA-N

Compound name

1,1-dicyclohexyl-3-methylurea

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 3
Patents: 238.20451 Da
Monoisotopic Mass: 3.2
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]+	239.21179	160.6
[M+Na]+	261.19373	167.9
[M+NH4]+	256.23833	169.2
[M+K]+	277.16767	161.8
[M-H]-	237.19723	165.4
[M+Na-2H]-	259.17918	165.5
[M]+	238.20396	162.5
[M]-	238.20506	162.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe