CID 23438842

[1,2,4]triazolo[1,5-a]pyridine-6-carboxylic acid

Structural Information

Molecular Formula
C7H5N3O2
SMILES
C1=CC2=NC=NN2C=C1C(=O)O
InChI
InChI=1S/C7H5N3O2/c11-7(12)5-1-2-6-8-4-9-10(6)3-5/h1-4H,(H,11,12)
InChIKey
YYUHEGMACRELPY-UHFFFAOYSA-N
Compound name
[1,2,4]triazolo[1,5-a]pyridine-6-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

54
Patents

163.03818 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 164.045456 129.1
[M+Na]+ 186.027398 140.2
[M-H]- 162.030904 129.3
[M+NH4]+ 181.072003 148.0
[M+K]+ 202.001338 137.6
[M+H-H2O]+ 146.035440 121.8
[M+HCOO]- 208.036381 150.6
[M+CH3COO]- 222.052031 143.0
[M+Na-2H]- 184.012846 137.5
[M]+ 163.03763142 130.9
[M]- 163.03872858 130.9
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