CID 373875

2-(4,5-dihydro-1h-imidazol-2-yl)-1h-benzimidazole

Structural Information

Molecular Formula
C10H10N4
SMILES
C1CN=C(N1)C2=NC3=CC=CC=C3N2
InChI
InChI=1S/C10H10N4/c1-2-4-8-7(3-1)13-10(14-8)9-11-5-6-12-9/h1-4H,5-6H2,(H,11,12)(H,13,14)
InChIKey
NMQLWFUDBDWZDY-UHFFFAOYSA-N
Compound name
2-(4,5-dihydro-1H-imidazol-2-yl)-1H-benzimidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

186.09055 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 187.09783 138.1
[M+Na]+ 209.07977 147.9
[M-H]- 185.08327 138.6
[M+NH4]+ 204.12437 155.5
[M+K]+ 225.05371 142.6
[M+H-H2O]+ 169.08781 129.4
[M+HCOO]- 231.08875 157.0
[M+CH3COO]- 245.10440 150.2
[M+Na-2H]- 207.06522 143.7
[M]+ 186.09000 135.2
[M]- 186.09110 135.2
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.