CID 3068986

Benzimidazole, 2-((p-methoxyphenoxy)methyl)-1-((pyrrolidinyl)methyl)-

Structural Information

Molecular Formula
C20H23N3O2
SMILES
COC1=CC=C(C=C1)OCC2=NC3=CC=CC=C3N2CN4CCCC4
InChI
InChI=1S/C20H23N3O2/c1-24-16-8-10-17(11-9-16)25-14-20-21-18-6-2-3-7-19(18)23(20)15-22-12-4-5-13-22/h2-3,6-11H,4-5,12-15H2,1H3
InChIKey
IRAMDIDDFYPUNS-UHFFFAOYSA-N
Compound name
2-[(4-methoxyphenoxy)methyl]-1-(pyrrolidin-1-ylmethyl)benzimidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

337.17902 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 338.186296 179.8
[M+Na]+ 360.168238 187.5
[M-H]- 336.171744 186.8
[M+NH4]+ 355.212843 193.5
[M+K]+ 376.142178 182.3
[M+H-H2O]+ 320.176280 169.1
[M+HCOO]- 382.177221 199.7
[M+CH3COO]- 396.192871 190.3
[M+Na-2H]- 358.153686 180.6
[M]+ 337.17847142 182.6
[M]- 337.17956858 182.6
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.