CID 22214792

[1,2,4]triazolo[4,3-a]pyridin-6-amine dihydrochloride

Structural Information

Molecular Formula
C6H6N4
SMILES
C1=CC2=NN=CN2C=C1N
InChI
InChI=1S/C6H6N4/c7-5-1-2-6-9-8-4-10(6)3-5/h1-4H,7H2
InChIKey
SVVISZMHLQZHNE-UHFFFAOYSA-N
Compound name
[1,2,4]triazolo[4,3-a]pyridin-6-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

77
Patents

134.05925 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 135.06653 122.2
[M+Na]+ 157.04847 133.7
[M-H]- 133.05197 123.3
[M+NH4]+ 152.09307 142.7
[M+K]+ 173.02241 130.8
[M+H-H2O]+ 117.05651 114.7
[M+HCOO]- 179.05745 146.5
[M+CH3COO]- 193.07310 136.8
[M+Na-2H]- 155.03392 132.4
[M]+ 134.05870 122.4
[M]- 134.05980 122.4
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

patents stripe