CID 306211

Methyl n-(3-chlorobenzoyl)anthranilate

Structural Information

Molecular Formula
C15H12ClNO3
SMILES
COC(=O)C1=CC=CC=C1NC(=O)C2=CC(=CC=C2)Cl
InChI
InChI=1S/C15H12ClNO3/c1-20-15(19)12-7-2-3-8-13(12)17-14(18)10-5-4-6-11(16)9-10/h2-9H,1H3,(H,17,18)
InChIKey
WFXJKIPVHFUFBE-UHFFFAOYSA-N
Compound name
methyl 2-[(3-chlorobenzoyl)amino]benzoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

289.05057 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 290.057846 162.5
[M+Na]+ 312.039788 170.5
[M-H]- 288.043294 169.5
[M+NH4]+ 307.084393 178.5
[M+K]+ 328.013728 166.1
[M+H-H2O]+ 272.047830 155.7
[M+HCOO]- 334.048771 182.2
[M+CH3COO]- 348.064421 200.9
[M+Na-2H]- 310.025236 166.2
[M]+ 289.05002142 165.9
[M]- 289.05111858 165.9
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.