CID 15817775

N-(2-methyl-3-chloro-5-hydroxyphenyl)anthranilic acid

Structural Information

Molecular Formula
C14H12ClNO3
SMILES
CC1=C(C=C(C=C1Cl)O)NC2=CC=CC=C2C(=O)O
InChI
InChI=1S/C14H12ClNO3/c1-8-11(15)6-9(17)7-13(8)16-12-5-3-2-4-10(12)14(18)19/h2-7,16-17H,1H3,(H,18,19)
InChIKey
CMXXNDVGOJPVAC-UHFFFAOYSA-N
Compound name
2-(3-chloro-5-hydroxy-2-methylanilino)benzoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

277.05057 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 278.05785 160.0
[M+Na]+ 300.03979 174.2
[M+NH4]+ 295.08439 167.6
[M+K]+ 316.01373 167.6
[M-H]- 276.04329 163.6
[M+Na-2H]- 298.02524 167.5
[M]+ 277.05002 163.3
[M]- 277.05112 163.3
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.