CID 45051289

2-(4-methoxyphenyl)-4-(2-methyl-1-piperidinyl)quinoline

Structural Information

Molecular Formula
C22H24N2O
SMILES
CC1CCCCN1C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)OC
InChI
InChI=1S/C22H24N2O/c1-16-7-5-6-14-24(16)22-15-21(17-10-12-18(25-2)13-11-17)23-20-9-4-3-8-19(20)22/h3-4,8-13,15-16H,5-7,14H2,1-2H3
InChIKey
BMVTZMBNLUGCKC-UHFFFAOYSA-N
Compound name
2-(4-methoxyphenyl)-4-(2-methylpiperidin-1-yl)quinoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

332.18887 Da
Monoisotopic Mass

5.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 333.196146 183.3
[M+Na]+ 355.178088 189.4
[M-H]- 331.181594 190.0
[M+NH4]+ 350.222693 194.6
[M+K]+ 371.152028 182.9
[M+H-H2O]+ 315.186130 171.4
[M+HCOO]- 377.187071 198.8
[M+CH3COO]- 391.202721 192.3
[M+Na-2H]- 353.163536 186.2
[M]+ 332.18832142 180.3
[M]- 332.18941858 180.3
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.