CID 5742811

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

Structural Information

Molecular Formula
C15H11N3
SMILES
CC1=CC2=C(C=C1)N=NC3=C2NC4=CC=CC=C43
InChI
InChI=1S/C15H11N3/c1-9-6-7-13-11(8-9)14-15(18-17-13)10-4-2-3-5-12(10)16-14/h2-8,16H,1H3
InChIKey
GQWJBYAYCAPJBE-UHFFFAOYSA-N
Compound name
2-methyl-11H-indolo[3,2-c]cinnoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

233.09529 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 234.10257 151.0
[M+Na]+ 256.08451 164.4
[M-H]- 232.08801 153.5
[M+NH4]+ 251.12911 169.5
[M+K]+ 272.05845 156.8
[M+H-H2O]+ 216.09255 142.6
[M+HCOO]- 278.09349 171.0
[M+CH3COO]- 292.10914 164.0
[M+Na-2H]- 254.06996 161.3
[M]+ 233.09474 153.7
[M]- 233.09584 153.7
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.