CID 124707333

6-chloro-[1,2,4]triazolo[1,5-b]pyridazin-2-amine

Structural Information

Molecular Formula
C5H4ClN5
SMILES
C1=CC(=NN2C1=NC(=N2)N)Cl
InChI
InChI=1S/C5H4ClN5/c6-3-1-2-4-8-5(7)10-11(4)9-3/h1-2H,(H2,7,10)
InChIKey
LSYPNSYAJJVVNS-UHFFFAOYSA-N
Compound name
6-chloro-[1,2,4]triazolo[1,5-b]pyridazin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

169.01552 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.022796 129.4
[M+Na]+ 192.004738 142.7
[M-H]- 168.008244 129.1
[M+NH4]+ 187.049343 148.0
[M+K]+ 207.978678 138.2
[M+H-H2O]+ 152.012780 121.5
[M+HCOO]- 214.013721 147.6
[M+CH3COO]- 228.029371 143.3
[M+Na-2H]- 189.990186 138.5
[M]+ 169.01497142 131.6
[M]- 169.01606858 131.6
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

patents stripe