CID 3008478

2,4-dicyclohexylquinolin-8-amine

Structural Information

Molecular Formula
C21H28N2
SMILES
C1CCC(CC1)C2=CC(=NC3=C2C=CC=C3N)C4CCCCC4
InChI
InChI=1S/C21H28N2/c22-19-13-7-12-17-18(15-8-3-1-4-9-15)14-20(23-21(17)19)16-10-5-2-6-11-16/h7,12-16H,1-6,8-11,22H2
InChIKey
NQAJSNIUIQUFIU-UHFFFAOYSA-N
Compound name
2,4-dicyclohexylquinolin-8-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

308.22525 Da
Monoisotopic Mass

6.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 309.23253 176.1
[M+Na]+ 331.21447 178.0
[M-H]- 307.21797 182.4
[M+NH4]+ 326.25907 188.9
[M+K]+ 347.18841 171.6
[M+H-H2O]+ 291.22251 165.4
[M+HCOO]- 353.22345 189.4
[M+CH3COO]- 367.23910 183.9
[M+Na-2H]- 329.19992 177.0
[M]+ 308.22470 164.8
[M]- 308.22580 164.8
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

No patent data available for this compound.