CID 5496200

8-chloro-1,3-dihydroxy-10h-acridin-9-one

Structural Information

Molecular Formula
C13H8ClNO3
SMILES
C1=CC2=C(C(=C1)Cl)C(=O)C3=C(N2)C=C(C=C3O)O
InChI
InChI=1S/C13H8ClNO3/c14-7-2-1-3-8-11(7)13(18)12-9(15-8)4-6(16)5-10(12)17/h1-5,16-17H,(H,15,18)
InChIKey
KVCOIMCNHUBVQL-UHFFFAOYSA-N
Compound name
8-chloro-1,3-dihydroxy-10H-acridin-9-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

0
Patents

261.01926 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 262.02654 150.4
[M+Na]+ 284.00848 164.1
[M-H]- 260.01198 152.3
[M+NH4]+ 279.05308 167.8
[M+K]+ 299.98242 156.6
[M+H-H2O]+ 244.01652 145.2
[M+HCOO]- 306.01746 165.1
[M+CH3COO]- 320.03311 163.2
[M+Na-2H]- 281.99393 158.7
[M]+ 261.01871 153.7
[M]- 261.01981 153.7
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

No patent data available for this compound.