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]+ 290.05785 162.5
[M+Na]+ 312.03979 170.5
[M-H]- 288.04329 169.5
[M+NH4]+ 307.08439 178.5
[M+K]+ 328.01373 166.1
[M+H-H2O]+ 272.04783 155.7
[M+HCOO]- 334.04877 182.2
[M+CH3COO]- 348.06442 200.9
[M+Na-2H]- 310.02524 166.2
[M]+ 289.05002 165.9
[M]- 289.05112 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.