CID 76530

3089-17-6

Structural Information

Molecular Formula
C20H10Cl2N2O2
SMILES
C1=CC2=C(C=C1Cl)C(=O)C3=CC4=C(C=C3N2)C(=O)C5=C(N4)C=CC(=C5)Cl
InChI
InChI=1S/C20H10Cl2N2O2/c21-9-1-3-15-11(5-9)19(25)13-8-18-14(7-17(13)23-15)20(26)12-6-10(22)2-4-16(12)24-18/h1-8H,(H,23,25)(H,24,26)
InChIKey
XPZQBGDNVOHQIS-UHFFFAOYSA-N
Compound name
2,9-dichloro-5,12-dihydroquinolino[2,3-b]acridine-7,14-dione
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

991
Patents

380.01193 Da
Monoisotopic Mass

5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 381.01921 184.8
[M+Na]+ 403.00115 207.6
[M+NH4]+ 398.04575 194.7
[M+K]+ 418.97509 195.4
[M-H]- 379.00465 189.5
[M+Na-2H]- 400.98660 192.8
[M]+ 380.01138 190.5
[M]- 380.01248 190.5
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