CID 160261

Rmi-11567 dihydrochloride

Structural Information

Molecular Formula
C20H22N2O3
SMILES
CN(C)CC(=O)C1=CC2=C(C=C1)OC3=C2C=C(C=C3)C(=O)CN(C)C
InChI
InChI=1S/C20H22N2O3/c1-21(2)11-17(23)13-5-7-19-15(9-13)16-10-14(6-8-20(16)25-19)18(24)12-22(3)4/h5-10H,11-12H2,1-4H3
InChIKey
BOVBIKZEYCNNDU-UHFFFAOYSA-N
Compound name
2-(dimethylamino)-1-[8-[2-(dimethylamino)acetyl]dibenzofuran-2-yl]ethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

12
Patents

338.16306 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 339.17034 182.8
[M+Na]+ 361.15228 189.8
[M-H]- 337.15578 191.8
[M+NH4]+ 356.19688 199.5
[M+K]+ 377.12622 189.2
[M+H-H2O]+ 321.16032 175.1
[M+HCOO]- 383.16126 206.2
[M+CH3COO]- 397.17691 225.6
[M+Na-2H]- 359.13773 185.2
[M]+ 338.16251 190.5
[M]- 338.16361 190.5
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.