CID 5274063

Ethyl 4-[(5-fluoro-2-hydroxy-benzoyl)amino]benzoate

Structural Information

Molecular Formula
C16H14FNO4
SMILES
CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)F)O
InChI
InChI=1S/C16H14FNO4/c1-2-22-16(21)10-3-6-12(7-4-10)18-15(20)13-9-11(17)5-8-14(13)19/h3-9,19H,2H2,1H3,(H,18,20)
InChIKey
ACCKUJZHCJQHBE-UHFFFAOYSA-N
Compound name
ethyl 4-[(5-fluoro-2-hydroxybenzoyl)amino]benzoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

303.0907 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 304.09798 166.9
[M+Na]+ 326.07992 173.9
[M-H]- 302.08342 171.3
[M+NH4]+ 321.12452 180.7
[M+K]+ 342.05386 170.6
[M+H-H2O]+ 286.08796 158.2
[M+HCOO]- 348.08890 188.2
[M+CH3COO]- 362.10455 203.9
[M+Na-2H]- 324.06537 168.7
[M]+ 303.09015 167.1
[M]- 303.09125 167.1
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.