CID 453043

N-isopropyl-2-phenylquinolin-4-amine

Structural Information

Molecular Formula
C18H18N2
SMILES
CC(C)NC1=CC(=NC2=CC=CC=C21)C3=CC=CC=C3
InChI
InChI=1S/C18H18N2/c1-13(2)19-18-12-17(14-8-4-3-5-9-14)20-16-11-7-6-10-15(16)18/h3-13H,1-2H3,(H,19,20)
InChIKey
LMTXKFFRXGLJEU-UHFFFAOYSA-N
Compound name
2-phenyl-N-propan-2-ylquinolin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

262.147 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.15428 161.5
[M+Na]+ 285.13622 168.5
[M-H]- 261.13972 167.5
[M+NH4]+ 280.18082 177.3
[M+K]+ 301.11016 163.0
[M+H-H2O]+ 245.14426 152.4
[M+HCOO]- 307.14520 182.9
[M+CH3COO]- 321.16085 172.9
[M+Na-2H]- 283.12167 168.5
[M]+ 262.14645 160.5
[M]- 262.14755 160.5
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.