CID 75357455

4-{7-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl}piperidine

Structural Information

Molecular Formula
C12H16N4
SMILES
CC1=CC2=NN=C(N2C=C1)C3CCNCC3
InChI
InChI=1S/C12H16N4/c1-9-4-7-16-11(8-9)14-15-12(16)10-2-5-13-6-3-10/h4,7-8,10,13H,2-3,5-6H2,1H3
InChIKey
JXAMAVKFYSRPGA-UHFFFAOYSA-N
Compound name
7-methyl-3-piperidin-4-yl-[1,2,4]triazolo[4,3-a]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

216.1375 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 217.14478 149.5
[M+Na]+ 239.12672 163.3
[M+NH4]+ 234.17132 157.7
[M+K]+ 255.10066 157.9
[M-H]- 215.13022 151.7
[M+Na-2H]- 237.11217 156.5
[M]+ 216.13695 152.0
[M]- 216.13805 152.0
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.