CID 5496158

1,5-dihydroxy-4-methoxy-3-methyl-10h-acridin-9-one

Structural Information

Molecular Formula
C15H13NO4
SMILES
CC1=CC(=C2C(=C1OC)NC3=C(C2=O)C=CC=C3O)O
InChI
InChI=1S/C15H13NO4/c1-7-6-10(18)11-13(15(7)20-2)16-12-8(14(11)19)4-3-5-9(12)17/h3-6,17-18H,1-2H3,(H,16,19)
InChIKey
CTKDQQDNZKBRCE-UHFFFAOYSA-N
Compound name
1,5-dihydroxy-4-methoxy-3-methyl-10H-acridin-9-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

271.08447 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 272.091746 158.1
[M+Na]+ 294.073688 170.6
[M-H]- 270.077194 160.1
[M+NH4]+ 289.118293 174.2
[M+K]+ 310.047628 165.1
[M+H-H2O]+ 254.081730 151.4
[M+HCOO]- 316.082671 176.6
[M+CH3COO]- 330.098321 194.9
[M+Na-2H]- 292.059136 164.9
[M]+ 271.08392142 161.6
[M]- 271.08501858 161.6
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.