CID 6433090

Imidafenacin

Structural Information

Molecular Formula
C20H21N3O
SMILES
CC1=NC=CN1CCC(C2=CC=CC=C2)(C3=CC=CC=C3)C(=O)N
InChI
InChI=1S/C20H21N3O/c1-16-22-13-15-23(16)14-12-20(19(21)24,17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2-11,13,15H,12,14H2,1H3,(H2,21,24)
InChIKey
SQKXYSGRELMAAU-UHFFFAOYSA-N
Compound name
4-(2-methylimidazol-1-yl)-2,2-diphenylbutanamide
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

92
References

1355
Patents

319.16846 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 320.17574 177.8
[M+Na]+ 342.15768 190.6
[M+NH4]+ 337.20228 184.8
[M+K]+ 358.13162 185.3
[M-H]- 318.16118 182.5
[M+Na-2H]- 340.14313 187.5
[M]+ 319.16791 180.9
[M]- 319.16901 180.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe