CID 337128

Nsc353906

Structural Information

Molecular Formula
C20H18N2O2
SMILES
CC1=C(NC2=C(C1=O)C=CC3=C2C=CC4=C3NC(=C(C4=O)C)C)C
InChI
InChI=1S/C20H18N2O2/c1-9-11(3)21-17-13-6-8-16-18(22-12(4)10(2)20(16)24)14(13)5-7-15(17)19(9)23/h5-8H,1-4H3,(H,21,23)(H,22,24)
InChIKey
DKRMUYVKXNFTFW-UHFFFAOYSA-N
Compound name
2,3,8,9-tetramethyl-4,10-dihydroquinolino[8,7-h]quinoline-1,7-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

318.13684 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 319.14412 177.2
[M+Na]+ 341.12606 191.4
[M-H]- 317.12956 180.2
[M+NH4]+ 336.17066 191.9
[M+K]+ 357.10000 182.8
[M+H-H2O]+ 301.13410 168.6
[M+HCOO]- 363.13504 193.2
[M+CH3COO]- 377.15069 188.5
[M+Na-2H]- 339.11151 182.8
[M]+ 318.13629 180.3
[M]- 318.13739 180.3
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.