CID 3062092

80221-64-3

Structural Information

Molecular Formula
C23H26N2
SMILES
CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)CCC4CCNCC4
InChI
InChI=1S/C23H26N2/c1-17-6-9-19(10-7-17)23-16-20(11-8-18-12-14-24-15-13-18)21-4-2-3-5-22(21)25-23/h2-7,9-10,16,18,24H,8,11-15H2,1H3
InChIKey
QHPTYISGXXTEBI-UHFFFAOYSA-N
Compound name
2-(4-methylphenyl)-4-(2-piperidin-4-ylethyl)quinoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

330.2096 Da
Monoisotopic Mass

5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 331.216876 183.4
[M+Na]+ 353.198818 187.9
[M-H]- 329.202324 188.2
[M+NH4]+ 348.243423 193.9
[M+K]+ 369.172758 179.6
[M+H-H2O]+ 313.206860 171.7
[M+HCOO]- 375.207801 196.9
[M+CH3COO]- 389.223451 191.2
[M+Na-2H]- 351.184266 186.2
[M]+ 330.20905142 177.2
[M]- 330.21014858 177.2
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