CID 3050888

67178-88-5

Structural Information

Molecular Formula
C14H16N4O
SMILES
CC1=C(C(=CC=C1)C)NC(=O)N2CCN3C2=NC=C3
InChI
InChI=1S/C14H16N4O/c1-10-4-3-5-11(2)12(10)16-14(19)18-9-8-17-7-6-15-13(17)18/h3-7H,8-9H2,1-2H3,(H,16,19)
InChIKey
HQJIZRXBRCVKHO-UHFFFAOYSA-N
Compound name
N-(2,6-dimethylphenyl)-2,3-dihydroimidazo[1,2-a]imidazole-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

256.13242 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 257.13970 159.5
[M+Na]+ 279.12164 168.2
[M-H]- 255.12514 164.1
[M+NH4]+ 274.16624 177.0
[M+K]+ 295.09558 164.4
[M+H-H2O]+ 239.12968 150.8
[M+HCOO]- 301.13062 180.4
[M+CH3COO]- 315.14627 171.4
[M+Na-2H]- 277.10709 161.2
[M]+ 256.13187 159.6
[M]- 256.13297 159.6
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.