CID 62539368

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

Structural Information

Molecular Formula
C10H12N4
SMILES
C1CC(C1)C2=NN=C3N2C=C(C=C3)N
InChI
InChI=1S/C10H12N4/c11-8-4-5-9-12-13-10(14(9)6-8)7-2-1-3-7/h4-7H,1-3,11H2
InChIKey
DSEYGKPXBQCVRR-UHFFFAOYSA-N
Compound name
3-cyclobutyl-[1,2,4]triazolo[4,3-a]pyridin-6-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

188.1062 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 189.113476 137.5
[M+Na]+ 211.095418 146.3
[M-H]- 187.098924 141.2
[M+NH4]+ 206.140023 149.4
[M+K]+ 227.069358 145.6
[M+H-H2O]+ 171.103460 123.9
[M+HCOO]- 233.104401 158.5
[M+CH3COO]- 247.120051 150.1
[M+Na-2H]- 209.080866 144.1
[M]+ 188.10565142 145.2
[M]- 188.10674858 145.2
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.