CID 3560758

24782-64-7

Structural Information

Molecular Formula
C14H9NO3
SMILES
C1=CC=C2C(=C1)C(=O)C3=C(N2)C(=CC=C3)C(=O)O
InChI
InChI=1S/C14H9NO3/c16-13-8-4-1-2-7-11(8)15-12-9(13)5-3-6-10(12)14(17)18/h1-7H,(H,15,16)(H,17,18)
InChIKey
BATAOFZEDHPRTM-UHFFFAOYSA-N
Compound name
9-oxo-10H-acridine-4-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

8
References

110
Patents

239.05824 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 240.065516 148.0
[M+Na]+ 262.047458 158.9
[M-H]- 238.050964 150.5
[M+NH4]+ 257.092063 165.2
[M+K]+ 278.021398 153.4
[M+H-H2O]+ 222.055500 141.1
[M+HCOO]- 284.056441 167.5
[M+CH3COO]- 298.072091 160.6
[M+Na-2H]- 260.032906 156.8
[M]+ 239.05769142 148.9
[M]- 239.05878858 148.9
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

patents stripe