CID 82555186

2-amino-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile

Structural Information

Molecular Formula
C7H5N5
SMILES
C1=CN2C(=NC(=N2)N)C(=C1)C#N
InChI
InChI=1S/C7H5N5/c8-4-5-2-1-3-12-6(5)10-7(9)11-12/h1-3H,(H2,9,11)
InChIKey
HSYMFGCYPAVTCD-UHFFFAOYSA-N
Compound name
2-amino-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

159.05449 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 160.061766 130.5
[M+Na]+ 182.043708 143.1
[M-H]- 158.047214 130.1
[M+NH4]+ 177.088313 147.5
[M+K]+ 198.017648 138.9
[M+H-H2O]+ 142.051750 115.6
[M+HCOO]- 204.052691 150.0
[M+CH3COO]- 218.068341 142.5
[M+Na-2H]- 180.029156 138.2
[M]+ 159.05394142 125.6
[M]- 159.05503858 125.6
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.