CID 53396

N-(4,7-dimethoxy-6-(2-(isopropylamino)ethoxy)-5-benzofuranyl)acetamide hydroiodide

Structural Information

Molecular Formula
C17H24N2O5
SMILES
CC(C)NCCOC1=C(C2=C(C=CO2)C(=C1NC(=O)C)OC)OC
InChI
InChI=1S/C17H24N2O5/c1-10(2)18-7-9-24-16-13(19-11(3)20)14(21-4)12-6-8-23-15(12)17(16)22-5/h6,8,10,18H,7,9H2,1-5H3,(H,19,20)
InChIKey
ZFXULWZBHVIVMK-UHFFFAOYSA-N
Compound name
N-[4,7-dimethoxy-6-[2-(propan-2-ylamino)ethoxy]-1-benzofuran-5-yl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

336.16852 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 337.175796 179.7
[M+Na]+ 359.157738 186.9
[M-H]- 335.161244 185.5
[M+NH4]+ 354.202343 194.9
[M+K]+ 375.131678 186.8
[M+H-H2O]+ 319.165780 172.5
[M+HCOO]- 381.166721 203.8
[M+CH3COO]- 395.182371 218.2
[M+Na-2H]- 357.143186 182.1
[M]+ 336.16797142 189.2
[M]- 336.16906858 189.2
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.