CID 5496205

5-chloro-1-hydroxy-3-methyl-10h-acridin-9-one

Structural Information

Molecular Formula
C14H10ClNO2
SMILES
CC1=CC2=C(C(=C1)O)C(=O)C3=C(N2)C(=CC=C3)Cl
InChI
InChI=1S/C14H10ClNO2/c1-7-5-10-12(11(17)6-7)14(18)8-3-2-4-9(15)13(8)16-10/h2-6,17H,1H3,(H,16,18)
InChIKey
ANYKGEUYKJDSJG-UHFFFAOYSA-N
Compound name
5-chloro-1-hydroxy-3-methyl-10H-acridin-9-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

259.04 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 260.04728 152.1
[M+Na]+ 282.02922 165.9
[M-H]- 258.03272 155.0
[M+NH4]+ 277.07382 170.3
[M+K]+ 298.00316 158.3
[M+H-H2O]+ 242.03726 146.4
[M+HCOO]- 304.03820 167.7
[M+CH3COO]- 318.05385 165.3
[M+Na-2H]- 280.01467 160.1
[M]+ 259.03945 156.0
[M]- 259.04055 156.0
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.