CID 3062071

Ethanone, 1-(2-(4-methylphenyl)-4-quinolinyl)-2-(4-piperidinyl)-

Structural Information

Molecular Formula
C23H24N2O
SMILES
CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)CC4CCNCC4
InChI
InChI=1S/C23H24N2O/c1-16-6-8-18(9-7-16)22-15-20(19-4-2-3-5-21(19)25-22)23(26)14-17-10-12-24-13-11-17/h2-9,15,17,24H,10-14H2,1H3
InChIKey
ZKGYIDHLFDNHQY-UHFFFAOYSA-N
Compound name
1-[2-(4-methylphenyl)quinolin-4-yl]-2-piperidin-4-ylethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

344.18887 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 345.19615 185.6
[M+Na]+ 367.17809 189.8
[M-H]- 343.18159 190.5
[M+NH4]+ 362.22269 195.3
[M+K]+ 383.15203 182.2
[M+H-H2O]+ 327.18613 174.0
[M+HCOO]- 389.18707 198.5
[M+CH3COO]- 403.20272 193.1
[M+Na-2H]- 365.16354 187.4
[M]+ 344.18832 179.5
[M]- 344.18942 179.5
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

patents stripe