CID 82469

10228-01-0

Structural Information

Molecular Formula
C21H14N2O2
SMILES
CC1=CC2=C(C=C1)NC3=C(C2=O)C=C4C(=C3)C(=O)C5=CC=CC=C5N4
InChI
InChI=1S/C21H14N2O2/c1-11-6-7-17-13(8-11)21(25)15-10-18-14(9-19(15)23-17)20(24)12-4-2-3-5-16(12)22-18/h2-10H,1H3,(H,22,24)(H,23,25)
InChIKey
MHNYFZUKHPYYCS-UHFFFAOYSA-N
Compound name
2-methyl-5,12-dihydroquinolino[2,3-b]acridine-7,14-dione
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

17
Patents

326.10553 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 327.11281 176.6
[M+Na]+ 349.09475 197.6
[M+NH4]+ 344.13935 186.0
[M+K]+ 365.06869 186.8
[M-H]- 325.09825 181.3
[M+Na-2H]- 347.08020 184.7
[M]+ 326.10498 181.4
[M]- 326.10608 181.4
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

patents stripe