CID 478646

2-amino-8-fluoroindolo[2,1-b]quinazoline-6,12-dione

Structural Information

Molecular Formula
C15H8FN3O2
SMILES
C1=CC2=C(C=C1N)C(=O)N3C4=C(C=C(C=C4)F)C(=O)C3=N2
InChI
InChI=1S/C15H8FN3O2/c16-7-1-4-12-10(5-7)13(20)14-18-11-3-2-8(17)6-9(11)15(21)19(12)14/h1-6H,17H2
InChIKey
WCBYBJRMPHYAEY-UHFFFAOYSA-N
Compound name
2-amino-8-fluoroindolo[2,1-b]quinazoline-6,12-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13
Patents

281.06006 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 282.06734 160.1
[M+Na]+ 304.04928 173.9
[M-H]- 280.05278 163.9
[M+NH4]+ 299.09388 178.5
[M+K]+ 320.02322 167.3
[M+H-H2O]+ 264.05732 151.6
[M+HCOO]- 326.05826 180.1
[M+CH3COO]- 340.07391 172.9
[M+Na-2H]- 302.03473 166.0
[M]+ 281.05951 161.5
[M]- 281.06061 161.5
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