CID 5276833

8-hydroxy-2,6-dimethoxy-9a,10-dihydro-4ah-acridin-9-one

Structural Information

Molecular Formula
C15H15NO4
SMILES
COC1=CC2C(C=C1)NC3=C(C2=O)C(=CC(=C3)OC)O
InChI
InChI=1S/C15H15NO4/c1-19-8-3-4-11-10(5-8)15(18)14-12(16-11)6-9(20-2)7-13(14)17/h3-7,10-11,16-17H,1-2H3
InChIKey
QOTUZQFLEHEQTL-UHFFFAOYSA-N
Compound name
8-hydroxy-2,6-dimethoxy-9a,10-dihydro-4aH-acridin-9-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

273.1001 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 274.10738 159.7
[M+Na]+ 296.08932 168.7
[M-H]- 272.09282 161.4
[M+NH4]+ 291.13392 175.8
[M+K]+ 312.06326 164.4
[M+H-H2O]+ 256.09736 152.6
[M+HCOO]- 318.09830 175.4
[M+CH3COO]- 332.11395 196.7
[M+Na-2H]- 294.07477 164.8
[M]+ 273.09955 160.2
[M]- 273.10065 160.2
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.