CID 321082

[1,2,3,4]tetrazolo[1,5-b]pyridazin-6-amine

Structural Information

Molecular Formula
C4H4N6
SMILES
C1=CC2=NN=NN2N=C1N
InChI
InChI=1S/C4H4N6/c5-3-1-2-4-6-8-9-10(4)7-3/h1-2H,(H2,5,7)
InChIKey
FCBRQZIPVWCKKL-UHFFFAOYSA-N
Compound name
tetrazolo[1,5-b]pyridazin-6-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

17
Patents

136.04974 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 137.05702 123.3
[M+Na]+ 159.03896 135.7
[M-H]- 135.04246 121.9
[M+NH4]+ 154.08356 140.9
[M+K]+ 175.01290 132.8
[M+H-H2O]+ 119.04700 114.6
[M+HCOO]- 181.04794 145.4
[M+CH3COO]- 195.06359 137.1
[M+Na-2H]- 157.02441 134.3
[M]+ 136.04919 123.8
[M]- 136.05029 123.8
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

patents stripe