CID 135424170

1,3-dihydroxy-9-acridinecarboxylic acid

Structural Information

Molecular Formula
C14H9NO4
SMILES
C1=CC=C2C(=C1)C(=C3C(=CC(=CC3=N2)O)O)C(=O)O
InChI
InChI=1S/C14H9NO4/c16-7-5-10-13(11(17)6-7)12(14(18)19)8-3-1-2-4-9(8)15-10/h1-6,16-17H,(H,18,19)
InChIKey
JYTNCILGSJWIDM-UHFFFAOYSA-N
Compound name
1,3-dihydroxyacridine-9-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

14
Patents

255.05316 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 256.06044 152.2
[M+Na]+ 278.04238 163.2
[M-H]- 254.04588 153.8
[M+NH4]+ 273.08698 168.3
[M+K]+ 294.01632 158.2
[M+H-H2O]+ 238.05042 145.6
[M+HCOO]- 300.05136 170.2
[M+CH3COO]- 314.06701 164.3
[M+Na-2H]- 276.02783 160.0
[M]+ 255.05261 154.0
[M]- 255.05371 154.0
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.