CID 3052289

Urea, n-(2,6-dimethylphenyl)-n'-(imino((2-methoxyethyl)amino)methyl)-, monohydrochloride

Structural Information

Molecular Formula
C13H20N4O2
SMILES
CC1=C(C(=CC=C1)C)NC(=O)NC(=NCCOC)N
InChI
InChI=1S/C13H20N4O2/c1-9-5-4-6-10(2)11(9)16-13(18)17-12(14)15-7-8-19-3/h4-6H,7-8H2,1-3H3,(H4,14,15,16,17,18)
InChIKey
HTZBIKBDOLTENM-UHFFFAOYSA-N
Compound name
1-(2,6-dimethylphenyl)-3-[N'-(2-methoxyethyl)carbamimidoyl]urea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

264.15863 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 265.16591 163.9
[M+Na]+ 287.14785 171.2
[M+NH4]+ 282.19245 169.5
[M+K]+ 303.12179 166.6
[M-H]- 263.15135 166.4
[M+Na-2H]- 285.13330 167.9
[M]+ 264.15808 165.0
[M]- 264.15918 165.0
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.