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]+ 160.06177 130.5
[M+Na]+ 182.04371 143.1
[M-H]- 158.04721 130.1
[M+NH4]+ 177.08831 147.5
[M+K]+ 198.01765 138.9
[M+H-H2O]+ 142.05175 115.6
[M+HCOO]- 204.05269 150.0
[M+CH3COO]- 218.06834 142.5
[M+Na-2H]- 180.02916 138.2
[M]+ 159.05394 125.6
[M]- 159.05504 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.