CID 15496061

5h,6h,7h,8h-[1,2,4]triazolo[1,5-a]pyridine

Structural Information

Molecular Formula
C6H9N3
SMILES
C1CCN2C(=NC=N2)C1
InChI
InChI=1S/C6H9N3/c1-2-4-9-6(3-1)7-5-8-9/h5H,1-4H2
InChIKey
AGBCFJLARPKYOP-UHFFFAOYSA-N
Compound name
5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

353
Patents

123.07965 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 124.08693 123.4
[M+Na]+ 146.06887 131.5
[M-H]- 122.07237 123.3
[M+NH4]+ 141.11347 144.2
[M+K]+ 162.04281 130.0
[M+H-H2O]+ 106.07691 115.5
[M+HCOO]- 168.07785 142.8
[M+CH3COO]- 182.09350 136.6
[M+Na-2H]- 144.05432 131.5
[M]+ 123.07910 120.4
[M]- 123.08020 120.4
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