CID 3053351

Acetamide, n-(6-(1-piperidinyl)-1,2,4-triazolo(4,3-b)pyridazin-3-yl)-

Structural Information

Molecular Formula
C12H16N6O
SMILES
CC(=O)NC1=NN=C2N1N=C(C=C2)N3CCCCC3
InChI
InChI=1S/C12H16N6O/c1-9(19)13-12-15-14-10-5-6-11(16-18(10)12)17-7-3-2-4-8-17/h5-6H,2-4,7-8H2,1H3,(H,13,15,19)
InChIKey
AWNPTPSPKVTLCY-UHFFFAOYSA-N
Compound name
N-(6-piperidin-1-yl-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

260.13855 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 261.14583 158.2
[M+Na]+ 283.12777 170.2
[M+NH4]+ 278.17237 164.3
[M+K]+ 299.10171 166.6
[M-H]- 259.13127 159.3
[M+Na-2H]- 281.11322 164.2
[M]+ 260.13800 159.8
[M]- 260.13910 159.8
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.