CID 3020566

2-(1-methylpiperidin-4-yl)pyridine

Structural Information

Molecular Formula
C11H16N2
SMILES
CN1CCC(CC1)C2=CC=CC=N2
InChI
InChI=1S/C11H16N2/c1-13-8-5-10(6-9-13)11-4-2-3-7-12-11/h2-4,7,10H,5-6,8-9H2,1H3
InChIKey
VIPMWEOMYMZBAQ-UHFFFAOYSA-N
Compound name
2-(1-methylpiperidin-4-yl)pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

66
Patents

176.13135 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 177.138626 140.0
[M+Na]+ 199.120568 145.8
[M-H]- 175.124074 143.1
[M+NH4]+ 194.165173 157.1
[M+K]+ 215.094508 143.0
[M+H-H2O]+ 159.128610 131.4
[M+HCOO]- 221.129551 158.4
[M+CH3COO]- 235.145201 151.8
[M+Na-2H]- 197.106016 146.0
[M]+ 176.13080142 135.1
[M]- 176.13189858 135.1
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