CID 3068989

84138-41-0

Structural Information

Molecular Formula
C20H23N3O3
SMILES
COC1=CC=C(C=C1)OCC2=NC3=CC=CC=C3N2CN4CCOCC4
InChI
InChI=1S/C20H23N3O3/c1-24-16-6-8-17(9-7-16)26-14-20-21-18-4-2-3-5-19(18)23(20)15-22-10-12-25-13-11-22/h2-9H,10-15H2,1H3
InChIKey
XXXPDMJCKWPLNJ-UHFFFAOYSA-N
Compound name
4-[[2-[(4-methoxyphenoxy)methyl]benzimidazol-1-yl]methyl]morpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

353.17395 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 354.181226 183.6
[M+Na]+ 376.163168 190.5
[M-H]- 352.166674 190.3
[M+NH4]+ 371.207773 193.1
[M+K]+ 392.137108 186.5
[M+H-H2O]+ 336.171210 171.9
[M+HCOO]- 398.172151 200.2
[M+CH3COO]- 412.187801 193.1
[M+Na-2H]- 374.148616 186.8
[M]+ 353.17340142 185.8
[M]- 353.17449858 185.8
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.