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
2
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]+ 263.154276 161.5
[M+Na]+ 285.136218 168.5
[M-H]- 261.139724 167.5
[M+NH4]+ 280.180823 177.3
[M+K]+ 301.110158 163.0
[M+H-H2O]+ 245.144260 152.4
[M+HCOO]- 307.145201 182.9
[M+CH3COO]- 321.160851 172.9
[M+Na-2H]- 283.121666 168.5
[M]+ 262.14645142 160.5
[M]- 262.14754858 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.