CID 53400

Acetamide, n-(4,7-dimethoxy-6-(2-morpholinoethoxy)-5-benzofuranyl)-, hydrochloride

Structural Information

Molecular Formula
C18H24N2O6
SMILES
CC(=O)NC1=C(C2=C(C(=C1OCCN3CCOCC3)OC)OC=C2)OC
InChI
InChI=1S/C18H24N2O6/c1-12(21)19-14-15(22-2)13-4-8-25-16(13)18(23-3)17(14)26-11-7-20-5-9-24-10-6-20/h4,8H,5-7,9-11H2,1-3H3,(H,19,21)
InChIKey
PQCPWZAMVZRJSH-UHFFFAOYSA-N
Compound name
N-[4,7-dimethoxy-6-(2-morpholin-4-ylethoxy)-1-benzofuran-5-yl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

364.16342 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 365.17070 184.3
[M+Na]+ 387.15264 190.5
[M-H]- 363.15614 191.8
[M+NH4]+ 382.19724 195.2
[M+K]+ 403.12658 190.9
[M+H-H2O]+ 347.16068 175.8
[M+HCOO]- 409.16162 203.0
[M+CH3COO]- 423.17727 217.3
[M+Na-2H]- 385.13809 186.9
[M]+ 364.16287 191.2
[M]- 364.16397 191.2
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.