CID 378075

11-methylpyrido[2,3-b]acridine-5,12-dione

Structural Information

Molecular Formula
C17H10N2O2
SMILES
CC1=C2C(=NC3=CC=CC=C13)C(=O)C4=C(C2=O)N=CC=C4
InChI
InChI=1S/C17H10N2O2/c1-9-10-5-2-3-7-12(10)19-15-13(9)17(21)14-11(16(15)20)6-4-8-18-14/h2-8H,1H3
InChIKey
PPOGFOSNBVRYBG-UHFFFAOYSA-N
Compound name
11-methylpyrido[2,3-b]acridine-5,12-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

1
Patents

274.07422 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 275.08150 161.4
[M+Na]+ 297.06344 173.2
[M-H]- 273.06694 165.6
[M+NH4]+ 292.10804 178.1
[M+K]+ 313.03738 166.9
[M+H-H2O]+ 257.07148 152.0
[M+HCOO]- 319.07242 178.9
[M+CH3COO]- 333.08807 173.4
[M+Na-2H]- 295.04889 169.8
[M]+ 274.07367 162.9
[M]- 274.07477 162.9
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

patents stripe