CID 21391

2-(p-anisyl)-1-(2-diethylaminoethyl)benzimidazole

Structural Information

Molecular Formula
C20H25N3O
SMILES
CCN(CC)CCN1C2=CC=CC=C2N=C1C3=CC=C(C=C3)OC
InChI
InChI=1S/C20H25N3O/c1-4-22(5-2)14-15-23-19-9-7-6-8-18(19)21-20(23)16-10-12-17(24-3)13-11-16/h6-13H,4-5,14-15H2,1-3H3
InChIKey
YLTOMFFHIPAEJR-UHFFFAOYSA-N
Compound name
N,N-diethyl-2-[2-(4-methoxyphenyl)benzimidazol-1-yl]ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

323.19977 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 324.20705 179.7
[M+Na]+ 346.18899 187.8
[M-H]- 322.19249 186.2
[M+NH4]+ 341.23359 194.6
[M+K]+ 362.16293 183.2
[M+H-H2O]+ 306.19703 169.6
[M+HCOO]- 368.19797 203.0
[M+CH3COO]- 382.21362 216.1
[M+Na-2H]- 344.17444 183.4
[M]+ 323.19922 185.9
[M]- 323.20032 185.9
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.