CID 5742812

8-methoxy-11h-indolo[3,2-c]cinnoline

Structural Information

Molecular Formula
C15H11N3O
SMILES
COC1=CC2=C(C=C1)NC3=C2N=NC4=CC=CC=C43
InChI
InChI=1S/C15H11N3O/c1-19-9-6-7-12-11(8-9)15-14(16-12)10-4-2-3-5-13(10)17-18-15/h2-8,16H,1H3
InChIKey
QSPNUEKKSQFHSF-UHFFFAOYSA-N
Compound name
8-methoxy-11H-indolo[3,2-c]cinnoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

249.09021 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 250.097486 154.1
[M+Na]+ 272.079428 167.3
[M-H]- 248.082934 156.6
[M+NH4]+ 267.124033 171.9
[M+K]+ 288.053368 160.4
[M+H-H2O]+ 232.087470 145.5
[M+HCOO]- 294.088411 174.3
[M+CH3COO]- 308.104061 166.9
[M+Na-2H]- 270.064876 164.5
[M]+ 249.08966142 158.2
[M]- 249.09075858 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

No patent data available for this compound.