CID 73920

Quinacridonequinone

Structural Information

Molecular Formula
C20H10N2O4
SMILES
C1=CC=C2C(=C1)C(=O)C3=C(N2)C(=O)C4=C(C3=O)NC5=CC=CC=C5C4=O
InChI
InChI=1S/C20H10N2O4/c23-17-9-5-1-3-7-11(9)21-15-13(17)19(25)16-14(20(15)26)18(24)10-6-2-4-8-12(10)22-16/h1-8H,(H,21,23)(H,22,24)
InChIKey
KSLLMGLKCVSKFF-UHFFFAOYSA-N
Compound name
5,12-dihydroquinolino[2,3-b]acridine-6,7,13,14-tetrone
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

3411
Patents

342.06406 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 343.07134 176.3
[M+Na]+ 365.05328 189.4
[M-H]- 341.05678 179.6
[M+NH4]+ 360.09788 189.6
[M+K]+ 381.02722 181.0
[M+H-H2O]+ 325.06132 166.4
[M+HCOO]- 387.06226 190.9
[M+CH3COO]- 401.07791 186.7
[M+Na-2H]- 363.03873 184.8
[M]+ 342.06351 177.6
[M]- 342.06461 177.6
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