CID 6323416

Cyanocinnoline

Structural Information

Molecular Formula
C24H20N4
SMILES
C1=CC=C(C=C1)C(=CC=NC2=C(N=NC3=CC=CC=C32)CN)C4=CC=CC=C4
InChI
InChI=1S/C24H20N4/c25-17-23-24(21-13-7-8-14-22(21)27-28-23)26-16-15-20(18-9-3-1-4-10-18)19-11-5-2-6-12-19/h1-16H,17,25H2
InChIKey
CUWRVIIPSSUUDJ-UHFFFAOYSA-N
Compound name
[4-(3,3-diphenylprop-2-enylideneamino)cinnolin-3-yl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

16
Patents

364.1688 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 365.17608 189.3
[M+Na]+ 387.15802 195.1
[M-H]- 363.16152 197.0
[M+NH4]+ 382.20262 198.7
[M+K]+ 403.13196 186.6
[M+H-H2O]+ 347.16606 176.8
[M+HCOO]- 409.16700 210.6
[M+CH3COO]- 423.18265 198.0
[M+Na-2H]- 385.14347 195.8
[M]+ 364.16825 186.7
[M]- 364.16935 186.7
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

patents stripe