CID 67304671

4h,5h,6h,7h-pyrazolo[1,5-b]pyridazine

Structural Information

Molecular Formula
C6H9N3
SMILES
C1CC2=CC=NN2NC1
InChI
InChI=1S/C6H9N3/c1-2-6-3-5-8-9(6)7-4-1/h3,5,7H,1-2,4H2
InChIKey
MGHAKTUKHJVSSK-UHFFFAOYSA-N
Compound name
4,5,6,7-tetrahydropyrazolo[1,5-b]pyridazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

123.07965 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 124.086926 124.0
[M+Na]+ 146.068868 131.7
[M-H]- 122.072374 122.6
[M+NH4]+ 141.113473 144.2
[M+K]+ 162.042808 129.3
[M+H-H2O]+ 106.076910 116.5
[M+HCOO]- 168.077851 141.9
[M+CH3COO]- 182.093501 136.5
[M+Na-2H]- 144.054316 131.7
[M]+ 123.07910142 119.2
[M]- 123.08019858 119.2
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

patents stripe