CID 25957

Brn 0769007

Structural Information

Molecular Formula
C24H31N3O2
SMILES
CCN(CC)CCN1C2=C(C=C(C=C2)C(=O)C)N=C1CC3=CC=C(C=C3)OCC
InChI
InChI=1S/C24H31N3O2/c1-5-26(6-2)14-15-27-23-13-10-20(18(4)28)17-22(23)25-24(27)16-19-8-11-21(12-9-19)29-7-3/h8-13,17H,5-7,14-16H2,1-4H3
InChIKey
CFGBPNSLTKLAKK-UHFFFAOYSA-N
Compound name
1-[1-[2-(diethylamino)ethyl]-2-[(4-ethoxyphenyl)methyl]benzimidazol-5-yl]ethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

393.24164 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 394.24892 199.1
[M+Na]+ 416.23086 212.5
[M+NH4]+ 411.27546 205.6
[M+K]+ 432.20480 206.0
[M-H]- 392.23436 203.0
[M+Na-2H]- 414.21631 205.3
[M]+ 393.24109 202.1
[M]- 393.24219 202.1
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

No patent data available for this compound.