CID 75355416

1519824-36-2

Structural Information

Molecular Formula
C11H18N4
SMILES
C1CCN2C(=NN=C2C3CCNCC3)C1
InChI
InChI=1S/C11H18N4/c1-2-8-15-10(3-1)13-14-11(15)9-4-6-12-7-5-9/h9,12H,1-8H2
InChIKey
MJWDIRGKIDJHDC-UHFFFAOYSA-N
Compound name
3-piperidin-4-yl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

206.15315 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.16043 149.8
[M+Na]+ 229.14237 160.7
[M+NH4]+ 224.18697 157.9
[M+K]+ 245.11631 155.9
[M-H]- 205.14587 151.4
[M+Na-2H]- 227.12782 154.5
[M]+ 206.15260 151.5
[M]- 206.15370 151.5
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.