CID 3041556

2-acridinecarboxylic acid

Structural Information

Molecular Formula
C14H9NO2
SMILES
C1=CC=C2C(=C1)C=C3C=C(C=CC3=N2)C(=O)O
InChI
InChI=1S/C14H9NO2/c16-14(17)10-5-6-13-11(8-10)7-9-3-1-2-4-12(9)15-13/h1-8H,(H,16,17)
InChIKey
ZCIXDWOBWIAUNV-UHFFFAOYSA-N
Compound name
acridine-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

80
Patents

223.06332 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 224.07060 145.2
[M+Na]+ 246.05254 155.6
[M-H]- 222.05604 148.7
[M+NH4]+ 241.09714 163.6
[M+K]+ 262.02648 150.7
[M+H-H2O]+ 206.06058 138.0
[M+HCOO]- 268.06152 165.9
[M+CH3COO]- 282.07717 158.3
[M+Na-2H]- 244.03799 155.2
[M]+ 223.06277 146.8
[M]- 223.06387 146.8
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