CID 3060929

C 3145

Structural Information

Molecular Formula
C15H25N3O
SMILES
CCN(CC)CCNC(=O)NC1=C(C=CC=C1C)C
InChI
InChI=1S/C15H25N3O/c1-5-18(6-2)11-10-16-15(19)17-14-12(3)8-7-9-13(14)4/h7-9H,5-6,10-11H2,1-4H3,(H2,16,17,19)
InChIKey
DCTITFAMTSDORB-UHFFFAOYSA-N
Compound name
1-[2-(diethylamino)ethyl]-3-(2,6-dimethylphenyl)urea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

263.19977 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 264.20705 166.5
[M+Na]+ 286.18899 175.5
[M+NH4]+ 281.23359 173.3
[M+K]+ 302.16293 169.3
[M-H]- 262.19249 169.7
[M+Na-2H]- 284.17444 171.4
[M]+ 263.19922 168.4
[M]- 263.20032 168.4
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.