CID 45051293

2-(4-ethylphenyl)-4-(4-morpholinyl)quinoline

Structural Information

Molecular Formula
C21H22N2O
SMILES
CCC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)N4CCOCC4
InChI
InChI=1S/C21H22N2O/c1-2-16-7-9-17(10-8-16)20-15-21(23-11-13-24-14-12-23)18-5-3-4-6-19(18)22-20/h3-10,15H,2,11-14H2,1H3
InChIKey
CCHHVWLFYHFQTR-UHFFFAOYSA-N
Compound name
4-[2-(4-ethylphenyl)quinolin-4-yl]morpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

318.17322 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 319.18050 178.6
[M+Na]+ 341.16244 184.6
[M-H]- 317.16594 185.8
[M+NH4]+ 336.20704 189.0
[M+K]+ 357.13638 179.2
[M+H-H2O]+ 301.17048 166.8
[M+HCOO]- 363.17142 193.6
[M+CH3COO]- 377.18707 187.9
[M+Na-2H]- 339.14789 183.3
[M]+ 318.17267 175.5
[M]- 318.17377 175.5
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

No patent data available for this compound.