CID 10854547

301538-61-4

Structural Information

Molecular Formula
C19H17NO5
SMILES
CCOC(=O)COC1=CC=CC2=C1OC(=C2N)C(=O)C3=CC=CC=C3
InChI
InChI=1S/C19H17NO5/c1-2-23-15(21)11-24-14-10-6-9-13-16(20)19(25-18(13)14)17(22)12-7-4-3-5-8-12/h3-10H,2,11,20H2,1H3
InChIKey
AODAUEOBAXFWMI-UHFFFAOYSA-N
Compound name
ethyl 2-[(3-amino-2-benzoyl-1-benzofuran-7-yl)oxy]acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

339.1107 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 340.117976 178.3
[M+Na]+ 362.099918 186.3
[M-H]- 338.103424 186.9
[M+NH4]+ 357.144523 192.5
[M+K]+ 378.073858 184.3
[M+H-H2O]+ 322.107960 170.5
[M+HCOO]- 384.108901 201.7
[M+CH3COO]- 398.124551 212.3
[M+Na-2H]- 360.085366 181.0
[M]+ 339.11015142 184.6
[M]- 339.11124858 184.6
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.