CID 79973

6,13-dihydroquinacridone

Structural Information

Molecular Formula
C20H14N2O2
SMILES
C1C2=C(CC3=C1NC4=CC=CC=C4C3=O)NC5=CC=CC=C5C2=O
InChI
InChI=1S/C20H14N2O2/c23-19-11-5-1-3-7-15(11)21-17-10-14-18(9-13(17)19)22-16-8-4-2-6-12(16)20(14)24/h1-8H,9-10H2,(H,21,23)(H,22,24)
InChIKey
SNDAOXYSCAWUFQ-UHFFFAOYSA-N
Compound name
5,6,12,13-tetrahydroquinolino[2,3-b]acridine-7,14-dione
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

362
Patents

314.10553 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 315.11281 172.8
[M+Na]+ 337.09475 191.8
[M+NH4]+ 332.13935 182.2
[M+K]+ 353.06869 181.5
[M-H]- 313.09825 176.9
[M+Na-2H]- 335.08020 179.7
[M]+ 314.10498 176.9
[M]- 314.10608 176.9
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