CID 378823

Nsc662141

Structural Information

Molecular Formula
C26H24N2O3
SMILES
CC1=C2C(=CC=C1)N(C3=C(C(=C4C(=C3C2=O)N(C5=CC=CC(=C5C4=O)C)C)OC)C)C
InChI
InChI=1S/C26H24N2O3/c1-13-9-7-11-16-18(13)24(29)20-22(27(16)4)15(3)26(31-6)21-23(20)28(5)17-12-8-10-14(2)19(17)25(21)30/h7-12H,1-6H3
InChIKey
UVOSCSFGSZGFNT-UHFFFAOYSA-N
Compound name
7-methoxy-1,5,6,9,13-pentamethylquinolino[2,3-c]acridine-8,14-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

412.17868 Da
Monoisotopic Mass

5.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 413.18596 207.0
[M+Na]+ 435.16790 222.8
[M-H]- 411.17140 213.7
[M+NH4]+ 430.21250 220.0
[M+K]+ 451.14184 215.3
[M+H-H2O]+ 395.17594 195.3
[M+HCOO]- 457.17688 223.9
[M+CH3COO]- 471.19253 217.8
[M+Na-2H]- 433.15335 211.0
[M]+ 412.17813 217.3
[M]- 412.17923 217.3
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.