CID 11956691

51566-48-4

Structural Information

Molecular Formula
C19H16N4
SMILES
CC1=CC(=NC(=C1C#N)NC2=CC=CC=C2)NC3=CC=CC=C3
InChI
InChI=1S/C19H16N4/c1-14-12-18(21-15-8-4-2-5-9-15)23-19(17(14)13-20)22-16-10-6-3-7-11-16/h2-12H,1H3,(H2,21,22,23)
InChIKey
TYFMUVFYDRDOBX-UHFFFAOYSA-N
Compound name
2,6-dianilino-4-methylpyridine-3-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

23
Patents

300.13748 Da
Monoisotopic Mass

5.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 301.14476 178.9
[M+Na]+ 323.12670 193.7
[M+NH4]+ 318.17130 183.9
[M+K]+ 339.10064 181.0
[M-H]- 299.13020 179.0
[M+Na-2H]- 321.11215 187.2
[M]+ 300.13693 180.4
[M]- 300.13803 180.4
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