CID 379481

Brn 5445378

Structural Information

Molecular Formula
C18H13N3O2
SMILES
CNC(=O)C1=CC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C41
InChI
InChI=1S/C18H13N3O2/c1-19-17(22)13-10-16-20-14-8-4-2-7-12(14)18(23)21(16)15-9-5-3-6-11(13)15/h2-10H,1H3,(H,19,22)
InChIKey
OUGDIUVHUGTHEK-UHFFFAOYSA-N
Compound name
N-methyl-12-oxoquinolino[2,1-b]quinazoline-5-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

303.10077 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 304.10805 168.2
[M+Na]+ 326.08999 185.8
[M+NH4]+ 321.13459 176.9
[M+K]+ 342.06393 176.9
[M-H]- 302.09349 172.4
[M+Na-2H]- 324.07544 176.2
[M]+ 303.10022 172.1
[M]- 303.10132 172.1
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