CID 230710

5465-86-1

Structural Information

Molecular Formula
C15H18N2
SMILES
CC1=CC(=NC2=CC=CC=C12)N3CCCCC3
InChI
InChI=1S/C15H18N2/c1-12-11-15(17-9-5-2-6-10-17)16-14-8-4-3-7-13(12)14/h3-4,7-8,11H,2,5-6,9-10H2,1H3
InChIKey
USYRQXDHKXGTCK-UHFFFAOYSA-N
Compound name
4-methyl-2-piperidin-1-ylquinoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

29
References

30
Patents

226.147 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 227.15428 153.0
[M+Na]+ 249.13622 159.4
[M-H]- 225.13972 156.8
[M+NH4]+ 244.18082 169.1
[M+K]+ 265.11016 154.5
[M+H-H2O]+ 209.14426 143.5
[M+HCOO]- 271.14520 169.7
[M+CH3COO]- 285.16085 163.9
[M+Na-2H]- 247.12167 159.1
[M]+ 226.14645 148.4
[M]- 226.14755 148.4
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

patents stripe