CID 5742808

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

Structural Information

Molecular Formula
C14H9N3
SMILES
C1=CC=C2C(=C1)C3=C(N2)C4=CC=CC=C4N=N3
InChI
InChI=1S/C14H9N3/c1-3-7-11-9(5-1)14-13(15-11)10-6-2-4-8-12(10)16-17-14/h1-8,15H
InChIKey
INIUTIRISOYVHA-UHFFFAOYSA-N
Compound name
11H-indolo[3,2-c]cinnoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

2
Patents

219.07965 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 220.08693 145.2
[M+Na]+ 242.06887 158.2
[M-H]- 218.07237 147.5
[M+NH4]+ 237.11347 164.0
[M+K]+ 258.04281 150.9
[M+H-H2O]+ 202.07691 136.8
[M+HCOO]- 264.07785 165.7
[M+CH3COO]- 278.09350 158.4
[M+Na-2H]- 240.05432 156.9
[M]+ 219.07910 147.3
[M]- 219.08020 147.3
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