CID 3074531

3-cyano-5-dimethylaminopyrano(3,2-c)quinolin-2-one

Structural Information

Molecular Formula
C15H11N3O2
SMILES
CN(C)C1=NC2=CC=CC=C2C3=C1C=C(C(=O)O3)C#N
InChI
InChI=1S/C15H11N3O2/c1-18(2)14-11-7-9(8-16)15(19)20-13(11)10-5-3-4-6-12(10)17-14/h3-7H,1-2H3
InChIKey
DTFWDVYBERBUSS-UHFFFAOYSA-N
Compound name
5-(dimethylamino)-2-oxopyrano[3,2-c]quinoline-3-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

265.0851 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 266.09238 162.3
[M+Na]+ 288.07432 175.9
[M-H]- 264.07782 167.4
[M+NH4]+ 283.11892 177.0
[M+K]+ 304.04826 170.7
[M+H-H2O]+ 248.08236 147.4
[M+HCOO]- 310.08330 181.5
[M+CH3COO]- 324.09895 173.9
[M+Na-2H]- 286.05977 170.3
[M]+ 265.08455 162.2
[M]- 265.08565 162.2
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.