CID 5274015

Ethyl 4-[(2-hydroxybenzoyl)amino]benzoate

Structural Information

Molecular Formula
C16H15NO4
SMILES
CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=CC=C2O
InChI
InChI=1S/C16H15NO4/c1-2-21-16(20)11-7-9-12(10-8-11)17-15(19)13-5-3-4-6-14(13)18/h3-10,18H,2H2,1H3,(H,17,19)
InChIKey
JKZTUDMERBXZBA-UHFFFAOYSA-N
Compound name
ethyl 4-[(2-hydroxybenzoyl)amino]benzoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

1
Patents

285.1001 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 286.10738 164.2
[M+Na]+ 308.08932 170.2
[M-H]- 284.09282 169.7
[M+NH4]+ 303.13392 178.6
[M+K]+ 324.06326 167.3
[M+H-H2O]+ 268.09736 156.3
[M+HCOO]- 330.09830 186.7
[M+CH3COO]- 344.11395 200.0
[M+Na-2H]- 306.07477 167.3
[M]+ 285.09955 165.1
[M]- 285.10065 165.1
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

patents stripe