CID 264303

2,3-dihydropyrrolo(2,1-b)quinazoline-1,9-dione

Structural Information

Molecular Formula
C11H8N2O2
SMILES
C1CC(=O)N2C1=NC3=CC=CC=C3C2=O
InChI
InChI=1S/C11H8N2O2/c14-10-6-5-9-12-8-4-2-1-3-7(8)11(15)13(9)10/h1-4H,5-6H2
InChIKey
RYMQCZNCXBZWFL-UHFFFAOYSA-N
Compound name
2,3-dihydropyrrolo[2,1-b]quinazoline-1,9-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

200.05858 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 201.06586 139.1
[M+Na]+ 223.04780 150.6
[M-H]- 199.05130 142.6
[M+NH4]+ 218.09240 159.8
[M+K]+ 239.02174 146.5
[M+H-H2O]+ 183.05584 132.0
[M+HCOO]- 245.05678 160.2
[M+CH3COO]- 259.07243 153.0
[M+Na-2H]- 221.03325 146.5
[M]+ 200.05803 140.2
[M]- 200.05913 140.2
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