CID 478577

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

Structural Information

Molecular Formula
C16H10N2O2
SMILES
CC1=CC2=C(C=C1)N3C(=NC4=CC=CC=C4C3=O)C2=O
InChI
InChI=1S/C16H10N2O2/c1-9-6-7-13-11(8-9)14(19)15-17-12-5-3-2-4-10(12)16(20)18(13)15/h2-8H,1H3
InChIKey
DSZRZFCUYHAAAE-UHFFFAOYSA-N
Compound name
8-methylindolo[2,1-b]quinazoline-6,12-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

7
References

10
Patents

262.07422 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.08150 157.5
[M+Na]+ 285.06344 170.8
[M-H]- 261.06694 162.6
[M+NH4]+ 280.10804 176.9
[M+K]+ 301.03738 164.6
[M+H-H2O]+ 245.07148 149.5
[M+HCOO]- 307.07242 177.7
[M+CH3COO]- 321.08807 170.8
[M+Na-2H]- 283.04889 164.3
[M]+ 262.07367 161.1
[M]- 262.07477 161.1
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

No patent data available for this compound.