CID 66937011

[1,2,4]triazolo[1,5-a]pyridin-7-ol

Structural Information

Molecular Formula
C6H5N3O
SMILES
C1=CN2C(=CC1=O)N=CN2
InChI
InChI=1S/C6H5N3O/c10-5-1-2-9-6(3-5)7-4-8-9/h1-4H,(H,7,8)
InChIKey
BABOSZMRHSQJCE-UHFFFAOYSA-N
Compound name
3H-[1,2,4]triazolo[1,5-a]pyridin-7-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

108
Patents

135.04326 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 136.05054 122.4
[M+Na]+ 158.03248 136.6
[M+NH4]+ 153.07708 130.5
[M+K]+ 174.00642 132.4
[M-H]- 134.03598 122.5
[M+Na-2H]- 156.01793 129.7
[M]+ 135.04271 124.3
[M]- 135.04381 124.3
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