CID 2839510

4,6-diphenyl-2-(piperidin-1-yl)pyridine-3-carbonitrile

Structural Information

Molecular Formula
C23H21N3
SMILES
C1CCN(CC1)C2=C(C(=CC(=N2)C3=CC=CC=C3)C4=CC=CC=C4)C#N
InChI
InChI=1S/C23H21N3/c24-17-21-20(18-10-4-1-5-11-18)16-22(19-12-6-2-7-13-19)25-23(21)26-14-8-3-9-15-26/h1-2,4-7,10-13,16H,3,8-9,14-15H2
InChIKey
CZKQZXXJRAAXKY-UHFFFAOYSA-N
Compound name
4,6-diphenyl-2-piperidin-1-ylpyridine-3-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

339.17355 Da
Monoisotopic Mass

5.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 340.18083 185.3
[M+Na]+ 362.16277 193.0
[M-H]- 338.16627 190.7
[M+NH4]+ 357.20737 193.1
[M+K]+ 378.13671 182.3
[M+H-H2O]+ 322.17081 166.6
[M+HCOO]- 384.17175 198.2
[M+CH3COO]- 398.18740 192.1
[M+Na-2H]- 360.14822 187.0
[M]+ 339.17300 174.4
[M]- 339.17410 174.4
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