CID 479326

2-aminoindolo[2,1-b]quinazoline-6,12-dione

Structural Information

Molecular Formula
C15H9N3O2
SMILES
C1=CC=C2C(=C1)C(=O)C3=NC4=C(C=C(C=C4)N)C(=O)N23
InChI
InChI=1S/C15H9N3O2/c16-8-5-6-11-10(7-8)15(20)18-12-4-2-1-3-9(12)13(19)14(18)17-11/h1-7H,16H2
InChIKey
ZDOCSNHKLLZWOA-UHFFFAOYSA-N
Compound name
2-aminoindolo[2,1-b]quinazoline-6,12-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

5
Patents

263.0695 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 264.07678 156.3
[M+Na]+ 286.05872 169.2
[M-H]- 262.06222 161.1
[M+NH4]+ 281.10332 175.2
[M+K]+ 302.03266 163.0
[M+H-H2O]+ 246.06676 148.5
[M+HCOO]- 308.06770 177.4
[M+CH3COO]- 322.08335 169.4
[M+Na-2H]- 284.04417 163.6
[M]+ 263.06895 158.2
[M]- 263.07005 158.2
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