CID 99346

2-picoline, 5-(3-piperidino-1-propynyl)-

Structural Information

Molecular Formula
C14H18N2
SMILES
CC1=NC=C(C=C1)C#CCN2CCCCC2
InChI
InChI=1S/C14H18N2/c1-13-7-8-14(12-15-13)6-5-11-16-9-3-2-4-10-16/h7-8,12H,2-4,9-11H2,1H3
InChIKey
DQTWVOSUHAMERO-UHFFFAOYSA-N
Compound name
2-methyl-5-(3-piperidin-1-ylprop-1-ynyl)pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

214.147 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.15428 154.9
[M+Na]+ 237.13622 167.8
[M+NH4]+ 232.18082 159.9
[M+K]+ 253.11016 156.5
[M-H]- 213.13972 150.3
[M+Na-2H]- 235.12167 159.3
[M]+ 214.14645 154.6
[M]- 214.14755 154.6
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.