CID 15817774

N-(2-formyl-3-chlorophenyl)anthranilic acid

Structural Information

Molecular Formula
C14H10ClNO3
SMILES
C1=CC=C(C(=C1)C(=O)O)NC2=C(C(=CC=C2)Cl)C=O
InChI
InChI=1S/C14H10ClNO3/c15-11-5-3-7-13(10(11)8-17)16-12-6-2-1-4-9(12)14(18)19/h1-8,16H,(H,18,19)
InChIKey
LGDLLXQRAYRQSC-UHFFFAOYSA-N
Compound name
2-(3-chloro-2-formylanilino)benzoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

275.0349 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 276.04218 158.7
[M+Na]+ 298.02412 173.1
[M+NH4]+ 293.06872 166.3
[M+K]+ 313.99806 165.9
[M-H]- 274.02762 162.5
[M+Na-2H]- 296.00957 167.0
[M]+ 275.03435 162.0
[M]- 275.03545 162.0
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.