CID 375867

9(10h)-acridinone, 1,3-bis(acetyloxy)-10-methyl-

Structural Information

Molecular Formula
C18H15NO5
SMILES
CC(=O)OC1=CC2=C(C(=C1)OC(=O)C)C(=O)C3=CC=CC=C3N2C
InChI
InChI=1S/C18H15NO5/c1-10(20)23-12-8-15-17(16(9-12)24-11(2)21)18(22)13-6-4-5-7-14(13)19(15)3/h4-9H,1-3H3
InChIKey
NAYAWQCLUGXUJD-UHFFFAOYSA-N
Compound name
(1-acetyloxy-10-methyl-9-oxoacridin-3-yl) acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

325.09503 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 326.10231 170.8
[M+Na]+ 348.08425 182.1
[M-H]- 324.08775 176.1
[M+NH4]+ 343.12885 186.0
[M+K]+ 364.05819 179.0
[M+H-H2O]+ 308.09229 162.5
[M+HCOO]- 370.09323 191.2
[M+CH3COO]- 384.10888 210.7
[M+Na-2H]- 346.06970 175.9
[M]+ 325.09448 178.7
[M]- 325.09558 178.7
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.