CID 3042278

Urea, 1-(2-(1-benzimidazolyl)ethyl)-3-(2,2-dimethylpropionyl)-

Structural Information

Molecular Formula
C15H20N4O2
SMILES
CC(C)(C)C(=O)NC(=O)NCCN1C=NC2=CC=CC=C21
InChI
InChI=1S/C15H20N4O2/c1-15(2,3)13(20)18-14(21)16-8-9-19-10-17-11-6-4-5-7-12(11)19/h4-7,10H,8-9H2,1-3H3,(H2,16,18,20,21)
InChIKey
OLYZIPXGZKCQEW-UHFFFAOYSA-N
Compound name
N-[2-(benzimidazol-1-yl)ethylcarbamoyl]-2,2-dimethylpropanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

288.15863 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 289.16591 169.1
[M+Na]+ 311.14785 175.9
[M-H]- 287.15135 171.4
[M+NH4]+ 306.19245 184.6
[M+K]+ 327.12179 173.0
[M+H-H2O]+ 271.15589 161.2
[M+HCOO]- 333.15683 190.5
[M+CH3COO]- 347.17248 204.7
[M+Na-2H]- 309.13330 174.7
[M]+ 288.15808 171.5
[M]- 288.15918 171.5
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.