CID 199290

Anthranilic acid, n-(3-(dimethylamino)phenyl)-

Structural Information

Molecular Formula
C15H16N2O2
SMILES
CN(C)C1=CC=CC(=C1)NC2=CC=CC=C2C(=O)O
InChI
InChI=1S/C15H16N2O2/c1-17(2)12-7-5-6-11(10-12)16-14-9-4-3-8-13(14)15(18)19/h3-10,16H,1-2H3,(H,18,19)
InChIKey
DHYYAXTWXTWSAC-UHFFFAOYSA-N
Compound name
2-[3-(dimethylamino)anilino]benzoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

256.1212 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 257.12848 158.0
[M+Na]+ 279.11042 163.9
[M-H]- 255.11392 165.0
[M+NH4]+ 274.15502 174.1
[M+K]+ 295.08436 161.4
[M+H-H2O]+ 239.11846 150.0
[M+HCOO]- 301.11940 182.7
[M+CH3COO]- 315.13505 202.3
[M+Na-2H]- 277.09587 162.5
[M]+ 256.12065 157.7
[M]- 256.12175 157.7
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

patents stripe