CID 43630109

1-{[1,2,4]triazolo[4,3-a]pyridin-3-yl}butan-1-amine

Structural Information

Molecular Formula
C10H14N4
SMILES
CCCC(C1=NN=C2N1C=CC=C2)N
InChI
InChI=1S/C10H14N4/c1-2-5-8(11)10-13-12-9-6-3-4-7-14(9)10/h3-4,6-8H,2,5,11H2,1H3
InChIKey
RBOYUUKZWTVYLX-UHFFFAOYSA-N
Compound name
1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)butan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

190.12184 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.129116 141.4
[M+Na]+ 213.111058 150.7
[M-H]- 189.114564 141.9
[M+NH4]+ 208.155663 159.5
[M+K]+ 229.084998 147.3
[M+H-H2O]+ 173.119100 133.1
[M+HCOO]- 235.120041 163.2
[M+CH3COO]- 249.135691 154.0
[M+Na-2H]- 211.096506 148.2
[M]+ 190.12129142 142.3
[M]- 190.12238858 142.3
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

No patent data available for this compound.