CID 71755762

2-(propan-2-yl)-5h,6h,7h,8h-[1,2,4]triazolo[1,5-a]pyridin-8-amine

Structural Information

Molecular Formula
C9H16N4
SMILES
CC(C)C1=NN2CCCC(C2=N1)N
InChI
InChI=1S/C9H16N4/c1-6(2)8-11-9-7(10)4-3-5-13(9)12-8/h6-7H,3-5,10H2,1-2H3
InChIKey
IMRZKUTYLGRDJX-UHFFFAOYSA-N
Compound name
2-propan-2-yl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

180.1375 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 181.14478 141.9
[M+Na]+ 203.12672 149.5
[M-H]- 179.13022 141.8
[M+NH4]+ 198.17132 160.5
[M+K]+ 219.10066 147.1
[M+H-H2O]+ 163.13476 134.0
[M+HCOO]- 225.13570 159.7
[M+CH3COO]- 239.15135 184.9
[M+Na-2H]- 201.11217 145.3
[M]+ 180.13695 138.5
[M]- 180.13805 138.5
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.